Cas no 638214-11-6 (1,1'-Biphenyl, 3-(bromomethyl)-4'-(trifluoromethyl)-)
638214-11-6 structure
Product Name:1,1'-Biphenyl, 3-(bromomethyl)-4'-(trifluoromethyl)-
CAS No:638214-11-6
MF:C14H10BrF3
MW:315.128413677216
CID:425647
PubChem ID:46854961
Update Time:2025-04-19
1,1'-Biphenyl, 3-(bromomethyl)-4'-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,1'-Biphenyl, 3-(bromomethyl)-4'-(trifluoromethyl)-
- 1-(bromomethyl)-3-[4-(trifluoromethyl)phenyl]benzene
- 638214-11-6
- DTXSID20676766
- AKOS030535507
- SCHEMBL2244478
- AT15121
- 3-(Bromomethyl)-4'-(trifluoromethyl)biphenyl
- 3-(Bromomethyl)-4'-(trifluoromethyl)-1,1'-biphenyl
- 3-(4-trifluoromethylphenyl)benzyl bromide
-
- Inchi： 1S/C14H10BrF3/c15-9-10-2-1-3-12(8-10)11-4-6-13(7-5-11)14(16,17)18/h1-8H,9H2
- InChI Key： HEOKJBYSZUXWFG-UHFFFAOYSA-N
- SMILES： BrCC1=CC=CC(=C1)C1C=CC(C(F)(F)F)=CC=1
Computed Properties
- Exact Mass: 313.9918
- Monoisotopic Mass: 313.99180g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 256
- 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: 5
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
1,1'-Biphenyl, 3-(bromomethyl)-4'-(trifluoromethyl)- Related Literature
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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