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4α-Phenylcyclohexan-1α-ol, also known as phenylcyclohexanol, is a colorless liquid chemical compound with a molecular formula C12H16O. It features a floral, rose-like odor and is commonly used as a fragrance ingredient in various cosmetic and personal care products. 4α-Phenylcyclohexan-1α-ol is a mixture of isomeric cyclohexanol with a substituted phenyl group at the 4α-position. Phenylcyclohexanol is recognized for its potential therapeutic and medicinal properties, including anti-inflammatory and analgesic effects. It also plays a role in the synthesis of other organic compounds and pharmaceuticals, and may have industrial applications in the production of plasticizers and polymers.

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  • 7335-12-8 Structure
  • Basic information

    1. Product Name: 4α-Phenylcyclohexan-1α-ol
    2. Synonyms: Einecs 230-841-0;Cyclohexanol, 4-phenyl-, cis-;-Phenylcyclohexan-1&alpha
    3. CAS NO:7335-12-8
    4. Molecular Formula: C12H16O
    5. Molecular Weight: 176.25484
    6. EINECS: 230-841-0
    7. Product Categories: N/A
    8. Mol File: 7335-12-8.mol
  • Chemical Properties

    1. Melting Point: 76-77 °C
    2. Boiling Point: 295.8±29.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.051±0.06 g/cm3(Predicted)
    6. Refractive Index: 1.553
    7. Storage Temp.: Sealed in dry,Room Temperature
    8. Solubility: N/A
    9. PKA: 15.18±0.40(Predicted)
    10. CAS DataBase Reference: 4α-Phenylcyclohexan-1α-ol(CAS DataBase Reference)
    11. NIST Chemistry Reference: 4α-Phenylcyclohexan-1α-ol(7335-12-8)
    12. EPA Substance Registry System: 4α-Phenylcyclohexan-1α-ol(7335-12-8)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 7335-12-8(Hazardous Substances Data)

7335-12-8 Usage

Uses

Used in Cosmetic and Personal Care Industry:
4α-Phenylcyclohexan-1α-ol is used as a fragrance ingredient for its floral, rose-like scent, enhancing the sensory experience of various cosmetic and personal care products.
Used in Pharmaceutical Industry:
4α-Phenylcyclohexan-1α-ol is used as a potential therapeutic agent for its anti-inflammatory and analgesic effects, contributing to the development of treatments for pain and inflammation.
Used in Chemical Synthesis:
4α-Phenylcyclohexan-1α-ol is used as a key intermediate in the synthesis of other organic compounds and pharmaceuticals, facilitating the creation of a range of products.
Used in Industrial Applications:
4α-Phenylcyclohexan-1α-ol is used in the production of plasticizers and polymers, contributing to the development of various industrial materials.

Check Digit Verification of cas no

The CAS Registry Mumber 7335-12-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 7,3,3 and 5 respectively; the second part has 2 digits, 1 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 7335-12:
(6*7)+(5*3)+(4*3)+(3*5)+(2*1)+(1*2)=88
88 % 10 = 8
So 7335-12-8 is a valid CAS Registry Number.
InChI:InChI=1/C12H16O/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-5,11-13H,6-9H2/t11-,12+

7335-12-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-trans-phenylcyclohexanol

1.2 Other means of identification

Product number -
Other names 4-phenyl cyclohexanol

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:7335-12-8 SDS

7335-12-8Relevant articles and documents

PNO ligand containing planar chiral ferrocene and application thereof

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Paragraph 0111-0113, (2021/06/21)

The invention discloses a PNO ligand containing planar chiral ferrocene and application thereof. The PNO ligand containing planar chiral ferrocene is a planar chiral ferrocene-containing and phenol-containing PNO ligand as shown in a general formula (I) or (II) which is described in the specification, or a planar chiral ferrocene-containing and aryl-phosphoric-acid-containingPNO ligand containing as shown in a general formula (III) or (IV) which is described in the specification, or a planar chiral ferrocene-containing and carbon-chiral-phenol-containingPNO ligand as shown in a general formula (V) or (VI) which is described in the specification. The invention provides tridentate PNO ligands and processes for their complexation with transition metal salts or transition metal complexes; the introduction of salicylaldehyde and derivatives thereof, which are simple and easy to obtain, enables the ligands to have a bifunctionalization effect, and -OH in a formed catalyst has stronger acidity and is beneficial to combination with N/O in polar double bonds. Therefore, due to the bifunctionalization effect of the catalyst, the interaction between the catalyst and a substrate can be greatly improved, so a reaction can obtain higher catalytic activity and stereoselectivity.

Tridentate nitrogen phosphine ligand containing arylamine NH as well as preparation method and application thereof

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Paragraph 0121-0122, (2021/06/26)

The invention discloses a tridentate nitrogen phosphine ligand containing arylamine NH as well as a preparation method and application thereof, and belongs to the technical field of organic synthesis. The tridentate nitrogen phosphine ligand disclosed by the invention is the first case of tridentate nitrogen phosphine ligand containing not only a quinoline amine structure but also chiral ferrocene at present, a noble metal complex of the type of ligand shows good selectivity and extremely high catalytic activity in an asymmetric hydrogenation reaction, meanwhile, a cheap metal complex of the ligand can also show good selectivity and catalytic activity in the asymmetric hydrogenation reaction, and is very easy to modify in the aspects of electronic effect and space structure, so that the ligand has huge potential application value. A catalyst formed by the ligand and a transition metal complex can be used for catalyzing various reactions, can be used for synthesizing various drugs, and has important industrial application value.

Pincerlike molybdenum complex and preparation method thereof, catalytic composition and application thereof, and alcohol preparation method

-

Paragraph 0134-0140, (2021/08/11)

The invention discloses a clamp-type molybdenum complex, a preparation method, a corresponding catalyst composition and application. The method comprises the steps: obtaining 9 molybdenum complexes with different structures through coordination reaction of 2-(substituent ethyl)-(5, 6, 7, 8-tetrahydroquinolyl) amine and a corresponding carbonyl molybdenum metal precursor; and catalyzing a ketone compound transfer hydrogenation reaction through a molybdenum complex to generate 40 alcohol compounds. The preparation method of the molybdenum complex is simple, high in yield and good in stability. For a transfer hydrogenation reaction of ketone, the molybdenum-based catalytic system has high catalytic activity and small molybdenum loading capacity, is used for production of aromatic and aliphatic alcohols, and has the advantages of simple method, small environmental pollution and high yield.

Site-Selective Synthesis of Aryl Sulfides via Oxidative Aromatization of Cyclohexanones with Thiophenols

Deng, Guo-Jun,Huang, Huawen,Tang, Minli,Xiao, Fuhong

, (2021/12/27)

We have introduced a metal-free facile access for the thiolation/aromatization of cyclohexanones with thiophenols to the corresponding aryl sulfides. The dehydroaromatic reaction of non-aromatic cyclohexanones proceeded smoothly using oxygen as a green oxidant.

DNA-PK INHIBITING COMPOUNDS

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Paragraph 00218, (2021/03/19)

The present disclosure relates to DNA-PK inhibiting compounds and prodrugs thereof that are useful in the treatment of diseases, including cancer. In particular, the compounds sensitise cancers to therapies such as chemotherapy and radiotherapy.

5-ALKYL PYRROLIDINE OREXIN RECEPTOR AGONISTS

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Paragraph 0306; 0307, (2020/08/25)

The present invention is directed to 5-alkyl pyrrolidine compounds which are agonists of orexin receptors. The present invention is also directed to uses of the compounds described herein in the potential treatment or prevention of neurological and psychiatric disorders and diseases in which orexin receptors are involved. The present invention is also directed to compositions comprising these compounds. The present invention is also directed to uses of these compositions in the potential prevention or treatment of such diseases in which orexin receptors are involved.

GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE

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Paragraph 001894; 001896; 001936; 001937, (2021/01/22)

Described herein are compounds, methods of making such compounds, pharmaceutical compositions and medicaments containing such compounds, and methods of using such compounds to treat or prevent diseases or disorders associated with a defect in glyoxylate metabolism, for example a disease or disorder associated with the enzyme glycolate oxidase (GO) or alterations in oxalate metabolism. Such diseases or disorders include, for example, disorders of glyoxylate metabolism, including primary hyperoxaluria, that are associated with production of excessive amounts of oxalate.

Trans-Selective and Switchable Arene Hydrogenation of Phenol Derivatives

Bergander, Klaus,Glorius, Frank,Heusler, Arne,Wollenburg, Marco

, p. 11365 - 11370 (2020/11/24)

A trans-selective arene hydrogenation of abundant phenol derivatives catalyzed by a commercially available heterogeneous palladium catalyst is reported. The described method tolerates a variety of functional groups and provides access to a broad scope of trans-configurated cyclohexanols as potential building blocks for life sciences and beyond in a one-step procedure. The transformation is strategically important because arene hydrogenation preferentially delivers the opposite cis-isomers. The diastereoselectivity of the phenol hydrogenation can be switched to the cis-isomers by employing rhodium-based catalysts. Moreover, a protocol for the chemoselective hydrogenation of phenols to cyclohexanones was developed.

A Practical and Stereoselective In Situ NHC-Cobalt Catalytic System for Hydrogenation of Ketones and Aldehydes

Zhong, Rui,Wei, Zeyuan,Zhang, Wei,Liu, Shun,Liu, Qiang

supporting information, p. 1552 - 1566 (2019/06/14)

Homogeneous catalytic hydrogenation of carbonyl groups is a synthetically useful and widely applied organic transformation. Sustainable chemistry goals require replacing conventional noble transition metal catalysts for hydrogenation by earth-abundant base metals. Herein, we report how a practical in situ catalytic system generated by easily available pincer NHC precursors, CoCl2, and a base enabled efficient and high-yielding hydrogenation of a broad range of ketones and aldehydes (over 50 examples and a maximum turnover number [TON] of 2,610). This is the first example of NHC-Co-catalyzed hydrogenation of C=O bonds using flexible pincer NHC ligands consisting of a N-H substructure. Diastereodivergent hydrogenation of substituted cyclohexanone derivatives was also realized by fine-tuning of the steric bulk of pincer NHC ligands. Additionally, a bis(NHCs)-Co complex was successfully isolated and fully characterized, and it exhibits excellent catalytic activity that equals that of the in-situ-formed catalytic system. Catalytic hydrogenation is a powerful tool for the reduction of organic compounds in both fine and bulk chemical industries. To improve sustainability, more ecofriendly, inexpensive, and earth-abundant base metals should be employed to replace the precious metals that currently dominate the development of hydrogenation catalysts. However, the majority of the base-metal catalysts that have been reported involve expensive, complex, and often air- and moisture-sensitive phosphine ligands, impeding their widespread application. From a mixture of the stable CoCl2, imidazole salts, and a base, our newly developed catalytic system that formed easily in situ enables efficient and stereoselective hydrogenation of C=O bonds. We anticipate that this easily accessible catalytic system will create opportunities for the design of practical base-metal hydrogenation catalysts. A practical in situ catalytic system generated by a mixture of easily available pincer NHC precursors, CoCl2, and a base enabled highly efficient hydrogenation of a broad range of ketones and aldehydes (over 50 examples and up to a turnover number [TON] of 2,610). Diastereodivergent hydrogenation of substituted cyclohexanone derivatives was also realized in high selectivities. Moreover, the preparation of a well-defined bis(NHCs)-Co complex via this pincer NHC ligand consisting of a N-H substructure was successful, and it exhibits equally excellent catalytic activity for the hydrogenation of C=O bonds.

GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE

-

Paragraph 001936; 001937; 001939; 001978; 001979; 001980, (2019/07/17)

Described herein are compounds, methods of making such compounds, pharmaceutical compositions and medicaments containing such compounds, and methods of using such compounds to treat or prevent diseases or disorders associated with the enzyme glycolate oxidase (GO). Such diseases or disorders include, for example, disorders of glyoxylate metabolism, including primary hyperoxaluria, that are associated with production of excessive amounts of oxalate.

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