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202134-57-4 | Benzenemethanol, 4-(bromomethyl)-α,α-bis(trifluoromethyl)-
CAS No: 202134-57-4 Catalog No: AG00283B MDL No:MFCD09998077
Product Description
Catalog Number:
AG00283B
Chemical Name:
Benzenemethanol, 4-(bromomethyl)-α,α-bis(trifluoromethyl)-
CAS Number:
202134-57-4
Molecular Formula:
C10H7BrF6O
Molecular Weight:
337.0564
MDL Number:
MFCD09998077
IUPAC Name:
2-[4-(bromomethyl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
InChI:
InChI=1S/C10H7BrF6O/c11-5-6-1-3-7(4-2-6)8(18,9(12,13)14)10(15,16)17/h1-4,18H,5H2
InChI Key:
LVLBRKWIJOFEHS-UHFFFAOYSA-N
SMILES:
BrCc1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.958g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
337.059g/mol
Monoisotopic Mass:
335.958g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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