Cas no 59888-14-1 (Benzene, (1,2-difluoro-1-methylethyl)-)
59888-14-1 structure
Product Name:Benzene, (1,2-difluoro-1-methylethyl)-
CAS No:59888-14-1
MF:C9H10F2
MW:156.172509670258
CID:336950
PubChem ID:21731169
Update Time:2025-04-19
Benzene, (1,2-difluoro-1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, (1,2-difluoro-1-methylethyl)-
- 1,2-difluoropropan-2-ylbenzene
- DTXSID60617552
- 59888-14-1
- (1,2-Difluoropropan-2-yl)benzene
-
- Inchi： 1S/C9H10F2/c1-9(11,7-10)8-5-3-2-4-6-8/h2-6H,7H2,1H3
- InChI Key： CDNXZVNUJRSTMZ-UHFFFAOYSA-N
- SMILES： FC(C)(CF)C1C=CC=CC=1
Computed Properties
- Exact Mass: 156.0751
- Monoisotopic Mass: 156.07505664g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 119
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.6
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, (1,2-difluoro-1-methylethyl)- Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
-
J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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