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50921-39-6

Basic Information
CAS No.: 50921-39-6
Name: 1-(4-Chlorophenyl)-1-cyclobutanecarboxylic acid
Article Data: 9
Molecular Structure:
Molecular Structure of 50921-39-6 (1-(4-Chlorophenyl)-1-cyclobutanecarboxylic acid)
Formula: C11H11ClO2
Molecular Weight: 210.66
Synonyms: 1-(4-Chlorophenyl)-1-cyclobutanecarboxylicacid;1-(4-Chlorophenyl)cyclobutanecarboxylic acid;1-(p-Chlorophenyl)cyclobutanecarboxylic acid;
EINECS: 256-847-3
Density: 1.335 g/cm3
Melting Point: 80-90 °C
Boiling Point: 350.422 °C at 760 mmHg
Flash Point: 165.73 °C
Appearance: light yellow to purple crystalline powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 37/39-26
PSA: 37.30000
LogP: 2.84630
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    1-(4-CHLOROPHENYL)-1-CYCLOBUTANECARBOXYLIC ACID 50921-39-6 98% Storage:dry and ventilated place Package:suitable for shipping Application:1-(4-CHLOROPHENYL)-1-CYCLOBUTANECARBOXYLIC ACID 50921-39-6 98% Transportation:air shipping Port:shanghai

    Changzhou Run-chem Biotechnology Co., Ltd., established in 2021, is committed to the research and development of pharmaceutical intermediates, especially the customization and prod

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  • 1-(4-Chlorophenyl)-1-cyclobutanecarboxylic acid

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    50921-39-6

    1-(4-Chlorophenyl)-1-cyclobutanecarboxylic acid

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    Prime Molecular Co., Ltd. is a high-tech enterprise providing comprehensive customer service for pharmaceutical companies at home and abroad in accordance with international standards. Two R&D centers and two production sites in China, all well-equip

    Prime Molecular Co., Ltd. is an advanced chemical intermediates manufacture with ?two R&D centers and two production sites in China, all well-equipped with dedicated and profession

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  • 1-(4-Chlorophenyl)-1-cyclobutanecarboxylic acid

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    50921-39-6

    1-(4-Chlorophenyl)-1-cyclobutanecarboxylic acid

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    Molecular Formula C11H11ClO2 Molecular Weight 210.66 CAS Registry Number 50921-39-6 E…Appearance:White crystalline Storage:dry Package:25KG/FIBER DRUM Application:Pharmaceutical Intermediates Transportation:SHIPMENT Port:SHANG

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  • 1-(4-Chlorophenyl)cyclobutanecarboxylic acid

  • Casno:

    50921-39-6

    1-(4-Chlorophenyl)cyclobutanecarboxylic acid

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    high purity Application:Drug intermediates Materials intermediates and active molecules

    Novachemistry offers a broad range of specialty chemicals and customized synthesis services to a range of pharmaceutical, agrochemical and biochemical industries. Novachemistry has

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Specification

The IUPAC name of 1-(4-Chlorophenyl)-1-cyclobutanecarboxylic acid is 1-(4-chlorophenyl)cyclobutane-1-carboxylic acid. With the CAS registry number 50921-39-6, it is also named as Cyclobutanecarboxylicacid, 1-(4-chlorophenyl)-. The product is light yellow to purple crystalline powder, which should be stored in closed, cool and dry place. In addition, its molecular formula is C11H11ClO2 and its molecular weight is 210.66.

The other characteristics of 1-(4-Chlorophenyl)-1-cyclobutanecarboxylic acid  can be summarized as: (1)EINECS: 256-847-3; (2)ACD/LogP: 2.71; (3)# of Rule of 5 Violations: 0; (4)ACD/LogD (pH 5.5): 1.449; (5)ACD/BCF (pH 5.5): 3.702; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 38.886; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.597; (13)Molar Refractivity: 53.799 cm3; (14)Molar Volume: 157.793 cm3; (15)Surface Tension: 55.179 dyne/cm; (16)Density: 1.335 g/cm3; (17)Flash Point: 165.73 °C; (18)Melting Point: 80-90 °C; (19)Enthalpy of Vaporization: 62.791 kJ/mol; (20)Boiling Point: 350.422 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

Preparation of this product: this chemical can be prepared by 1-(4-Chlorophenyl)cyclobutanecarbonitrile.



This reaction needs KOH and Bis-(2-hydroxy-ethyl) ether. The yield is 73 %.

Uses of this product: it can be used to produce 1-(4-Chlorophenyl)cyclobutylmethanol.



This reaction needs LiAlH4 and diethyl ether. The yield is 74 %.

When you are using this chemical, please be cautious about it as the following: it is irritating to eyes, respiratory system and skin. In case of contact with eyes, please rinse immediately with plenty of water and seek medical advice. And you should wear suitable gloves and eye/face protection.

People can use the following data to convert to the molecule structure.
(1)SMILES: c1cc(ccc1C2(CCC2)C(=O)O)Cl
(2)InChI: InChI=1/C11H11ClO2/c12-9-4-2-8(3-5-9)11(10(13)14)6-1-7-11/h2-5H,1,6-7H2,(H,13,14)
(3)InChIKey: XYSRHOKREWGGFE-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C11H11ClO2/c12-9-4-2-8(3-5-9)11(10(13)14)6-1-7-11/h2-5H,1,6-7H2,(H,13,14)
(5)Std. InChIKey: XYSRHOKREWGGFE-UHFFFAOYSA-N