Cas no 80743-47-1 (Benzeneacetic acid, a-(1-methylethyl)-a-phenyl-)
80743-47-1 structure
Product Name:Benzeneacetic acid, a-(1-methylethyl)-a-phenyl-
CAS No:80743-47-1
MF:C17H18O2
MW:254.323625087738
CID:731906
PubChem ID:284213
Update Time:2025-04-19
Benzeneacetic acid, a-(1-methylethyl)-a-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetic acid, a-(1-methylethyl)-a-phenyl-
- 3-methyl-2,2-diphenylbutanoic acid
- 2,2-diphenyl-3-methylbutanoic acid
- 3-Methyl-2,2-diphenyl-buttersaeure
- 3-methyl-2,2-diphenyl-butyric acid
- Isopropyl-diphenyl-essigsaeure
- NSC139999
- SCHEMBL13641402
- diphenylisopropylacetic acid
- 80743-47-1
- NSC-139999
- DTXSID60300917
-
- Inchi： 1S/C17H18O2/c1-13(2)17(16(18)19,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,1-2H3,(H,18,19)
- InChI Key： FXTISJCWXCDHRG-UHFFFAOYSA-N
- SMILES： OC(C(C1C=CC=CC=1)(C1C=CC=CC=1)C(C)C)=O
Computed Properties
- Exact Mass: 254.13100
- Monoisotopic Mass: 254.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 278
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.2
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.30000
- LogP: 3.71330
Benzeneacetic acid, a-(1-methylethyl)-a-phenyl- Related Literature
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
80743-47-1 (Benzeneacetic acid, a-(1-methylethyl)-a-phenyl-) Related Products
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- 77-55-4(1-phenylcyclopentane-1-carboxylic acid)
- 46292-93-7((R)-Phenylsuccinic Acid)
- 37828-19-6(1-phenylcyclobutane-1-carboxylic acid)
- 6120-95-2(1-phenylcyclopropane-1-carboxylic acid)
- 90-27-7(2-Phenylbutyric acid)
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