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1-METHYLFLUORENE is an organic compound that belongs to the family of polycyclic aromatic hydrocarbons. It is characterized by its unique molecular structure, which consists of a fluorene ring with a methyl group attached to it. 1-METHYLFLUORENE is known for its distinct chemical properties and has been identified as a volatile constituent in Greek tobacco. Interestingly, it has been found to not possess mutagenic activity, which sets it apart from other compounds in its class.

1730-37-6

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1730-37-6 Usage

Uses

Used in Tobacco Industry:
1-METHYLFLUORENE is used as a volatile constituent in the Greek tobacco industry for its distinct chemical properties and aroma. The compound contributes to the overall flavor and sensory experience of the tobacco product without causing any mutagenic effects, making it a preferred choice for this application.
Used in Chemical Research:
1-METHYLFLUORENE serves as a valuable compound in the field of chemical research due to its unique molecular structure and properties. It can be used as a starting material or intermediate in the synthesis of various complex organic molecules, including pharmaceuticals, dyes, and other specialty chemicals. Its non-mutagenic nature also makes it a safer option for research purposes.
Used in Environmental Monitoring:
Given its presence in Greek tobacco and its non-mutagenic properties, 1-METHYLFLUORENE can be utilized in environmental monitoring and assessment programs. It can help in understanding the impact of tobacco-related emissions on air quality and human health, as well as in the development of strategies to mitigate potential risks associated with exposure to such compounds.

Synthesis Reference(s)

Journal of the American Chemical Society, 68, p. 751, 1946 DOI: 10.1021/ja01209a011

Check Digit Verification of cas no

The CAS Registry Mumber 1730-37-6 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 1,7,3 and 0 respectively; the second part has 2 digits, 3 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 1730-37:
(6*1)+(5*7)+(4*3)+(3*0)+(2*3)+(1*7)=66
66 % 10 = 6
So 1730-37-6 is a valid CAS Registry Number.
InChI:InChI=1/C14H12/c1-10-5-4-8-13-12-7-3-2-6-11(12)9-14(10)13/h2-8H,9H2,1H3

1730-37-6 Well-known Company Product Price

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  • Aldrich

  • (M46594)  1-Methylfluorene  98%

  • 1730-37-6

  • M46594-250MG

  • 815.49CNY

  • Detail

1730-37-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-methyl-9H-fluorene

1.2 Other means of identification

Product number -
Other names 9H-Fluorene,1-methyl

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:1730-37-6 SDS

1730-37-6Relevant academic research and scientific papers

Palladium-catalyzed synthesis of fluorenes by intramolecular c(sp 2)-h activation at room temperature

Fujihara, Tetsuaki,Tanji, Yutaka,Tsuji, Yasushi

, p. 805 - 808 (2020)

The synthesis of fluorenes by intramolecular Pd-catalyzed C(sp 2)-H activation of 2-arylbenzyl chlorides was conducted at room temperature by using commercially available triphenylphosphine and pivalic acid as ligands. The desired reactions proceeded efficiently at room temperature, and various substrates were converted into the corresponding fluorene derivatives in excellent yields.

Conformational Preference for the Binding of Biaryl Substrates and Inhibitors to the Active Site of Phenylethanolamine N-Methyltransferase

Grunewald, Gary L.,Carter, Anne E.,Sall, Daniel J.,Monn, James A.

, p. 60 - 65 (1988)

We have previously described regions of steric bulk tolerance in the aromatic-ring binding site of phenylethanolamine N-methyltransferase (PNMT, EC 2.1.1.28) for phenylethanolamine substrates and α-methylbenzylamine inhibitors.For bound substrates, this region is located in the vicinity of the para position of the aromatic ring, while for bound α-methylbenzylamine inhibitors, it is located in the region complementary to the meta position.In the present study, we sought to determine the preferred conformation of the biaryl portion of (m-phenylphenyl)- and (p-phenylphenyl)ethanolamine (4 and 5, respectively) as well as for m-phenyl and p-phenyl-α-methylbenzylamine (7 and 8, respectively) for PNMT active site interactions.Planar derivatives of 4,5,7, and 8 were obtained through the synthesis of 2-(1-fluorenyl)-2-hydroxyethylamine (9), 2-(2-fluorenyl)-2-hydroxyethylamine (10), 1-(1-fluorenyl)ethylamine (11), and 1-(2-fluorenyl)ethylamine (12).The four fluorene derivatives were examined for in vitro activity as substrates and inhibitors of the PNMT-catalyzed reaction.As in case of 4, 5, 7, and 8, we have observed a positional preference for the alkylamine side chain with respect to the biphenyl skeleton present in 9-12.Thus, fluorenylethanolamine 10 ("p-biphenyl") displays a Michaelis constant (Km = 26 μM) that is approximately 10 times lower than that for 9 ("m-bipenyl", Km = 297 μM); in the α-methylbenzylamine inhibitors, fluorenyl derivative 11 ("m-biphenyl", Ki = 4.14 μM) is approximately 40 times better than 12 ("p-biphenyl", Ki =185 μM) for in vitro inhibition of PNMT.In each case, conformational restriction of the biaryl system present in 4, 5, 7, and 8, such that the aromatic rings are coplanar, resulted in enhanced affinity for thr PNMT active site.Thus, conformational restriction of ethanolamine 5 (Km = 82 μM) and α-methylbenzylamine 7 (Ki = 89 μM) as in 11 (Ki = 4.14 μM) leads, in each case, to a stronger enzyme-ligand dissociable complex.These results, in conjunction with others from these laboratories, indicate that the PNMT active site beyond the zone that interacts with the central aromatic ring portion of phenylethanolamine substrates and α-methylbenzylamine inhibitors is essentially a flat, hydrophobic pocket.

A denitrogenative palladium-catalyzed cascade for regioselective synthesis of fluorenes

Fu, Wai Chung,Kwong, Fuk Yee

, p. 1411 - 1417 (2020)

We herein report a denitrogenative palladium-catalyzed cascade for the modular and regioselective synthesis of polysubstituted fluorenes. Hydrazone facilitates the Pd(ii) to Pd(iv) oxidative addition in a Catellani pathway and is also the methylene synthon in the proposed reaction. Aryl iodides and 2-bromoarylaldehyde hydrazones undergo a norbornene-controlled tandem reaction sequence to give a broad scope of fluorenes in the presence of a palladium catalyst. The method described is scalable and adaptable to a three-component reaction with in situ generation of the hydrazone group. Preliminary mechanistic investigations have been conducted.

Solid-state construction of zigzag periphery: Via intramolecular C-H insertion induced by alumina-mediated C-F activation

Akhmetov, Vladimir,Amsharov, Konstantin,F?rtsch, Andreas,Feofanov, Mikhail

, p. 12325 - 12328 (2021/11/30)

Caryl-F bond activation has become an important and quickly developing method for construction of carbon-based materials. We report that alumina-mediated C-F bond activation (AmCFA) enables construction of PAHs with zigzag periphery. This method includes

Decarbonylative Methylation of Aromatic Esters by a Nickel Catalyst

Okita, Toshimasa,Muto, Kei,Yamaguchi, Junichiro

, p. 3132 - 3135 (2018/05/28)

A Ni-catalyzed decarbonylative methylation of aromatic esters was achieved using methylaluminums as methylating agents. Dimethylaluminum chlorides uniquely worked as the methyl source. Because of the Lewis acidity of aluminum reagents, less reactive alkyl esters could also undergo the present methylation. By controlling the Lewis acidity of aluminum reagents, a chemoselective decarbonylative cross-coupling between alkyl esters and phenyl esters was successful.

Palladium-Catalyzed Formal [4 + 1] Annulation via Metal Carbene Migratory Insertion and C(sp2)-H Bond Functionalization

Xu, Shuai,Chen, Ri,Fu, Zihao,Zhou, Qi,Zhang, Yan,Wang, Jianbo

, p. 1993 - 1997 (2017/08/14)

A highly efficient and operationally simple palladium-catalyzed formal [4 + 1] annulation reaction has been developed. The reaction is featured by the formation of two different C-C bonds on a carbenic center. It represents a concise method for the synthesis of a wide range of polycyclic aromatic hydrocarbons (PAHs) and 1H-indenes with easily available (trimethylsilyl)diazomethane as the carbene source. Metal carbene migratory insertion and C(sp2)-H bond activation are proposed as the key steps in this transformation. The reaction further demonstrates the versatility of the carbene-based coupling in combination with various transition-metal-catalyzed transformations.

Efficient palladium-catalyzed C(sp2)-H activation towards the synthesis of fluorenes

Song, Juan,Li, Yali,Sun, Wei,Yi, Chenglong,Wu, Hao,Wang, Haotian,Ding, Keran,Xiao, Kang,Liu, Chao

, p. 9030 - 9033 (2016/11/11)

A facile protocol for the synthesis of fluorene derivatives has been developed through palladium-catalyzed cyclization of 2′-halo-diarylmethanes via activation of arylic C-H bonds. The reactions occurred smoothly and allowed both electron-rich and electron-deficient substrates to convert into their corresponding fluorenes in good to excellent yields. Studies revealed that this Pd-catalyzed cyclization was also available for the substrates of 2′-chloro-diarylmethanes and no catalyst poisoning occurred for 2′-iodo-diphenylmethane.

Halogen-Adjusted Chemoselective Synthesis of Fluorene Derivatives with Position-Controlled Substituents

Song, Juan,Sun, Wei,Li, Yali,Wei, Fuliang,Liu, Chao,Qian, Yan,Chen, Shufen

supporting information, p. 211 - 215 (2016/03/01)

Fluorenes have been synthesized through an efficient novel Pd-catalyzed tandem cross-coupling reaction; these substrates are fascinating building blocks found in organic photoelectric materials. The position of the substituent on fluorenes could be conveniently tuned by changing the halogen in the ortho-halobenzyl bromide substrates when coupled with various arylboronic acids. This newly developed synthetic approach could achieve the potential diversity in fluorene-based molecular architectures.

Palladium-Catalyzed Reaction of Haloarenes with Diarylethynes: Synthesis, Structural Analysis, and Properties of Methylene-Bridged Arenes

Lee, Che-Wei,Liu, En-Chih,Wu, Yao-Ting

, p. 10446 - 10456 (2015/11/18)

Fluorenes and methylene-bridged polyarenes were easily and efficiently synthesized from haloarenes (or aryl triflates) and diarylethynes by a one-pot, two-step procedure. This protocol involves the palladium-catalyzed cycloisomerization and a subsequent base-mediated retro-aldol condensation. A major advantage is that the starting materials need not have ortho functional groups to complete the annulation. The backbone of the designed products was enlarged using dihaloarenes, highly π-conjugated haloarenes, or diarylalkynes. The mechanism of the formation of benzo[a]fluorene was investigated. The bowl-shaped structure of methylene-bridged indenocorannulene was verified by X-ray crystallography. The photophysical and electrochemical properties of the products thus prepared were investigated.

Br?nsted acid-mediated intramolecular cyclization of biaryl triazenes for the synthesis of fluorenes and 9,10-dihydro-phenanthrenes

Xu, Lijun,Yang, Weijun,Zhang, Lili,Miao, Maozhong,Yang, Zhigen,Xu, Xin,Ren, Hongjun

, p. 9206 - 9221 (2015/01/08)

The efficient synthesis of fluorenes from biaryl triazenes is successfully developed. Up to 27 examples of biaryl triazenes are converted into their corresponding fluorene derivatives in the presence of CF3COOH (4.0 equiv). Mechanism research i

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