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Home > Fluorides > 207672-95-5
207672-95-5 | Benzene, 1-[2,2-difluoro-1-(trifluoromethyl)ethenyl]-3-methyl-
CAS No: 207672-95-5 Catalog No: AG002J7C MDL No:
Product Description
Catalog Number:
AG002J7C
Chemical Name:
Benzene, 1-[2,2-difluoro-1-(trifluoromethyl)ethenyl]-3-methyl-
CAS Number:
207672-95-5
Molecular Formula:
C10H7F5
Molecular Weight:
222.1546
IUPAC Name:
1-methyl-3-(1,1,3,3,3-pentafluoroprop-1-en-2-yl)benzene
InChI:
InChI=1S/C10H7F5/c1-6-3-2-4-7(5-6)8(9(11)12)10(13,14)15/h2-5H,1H3
InChI Key:
DAGNAWPABRSHAT-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)C(=C(F)F)C(F)(F)F
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.047g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.158g/mol
Monoisotopic Mass:
222.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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