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261763-22-8 | Benzene, 1-(bromomethyl)-2-chloro-3-(trifluoromethyl)-
CAS No: 261763-22-8 Catalog No: AG002S2R MDL No:MFCD01631539
Product Description
Catalog Number:
AG002S2R
Chemical Name:
Benzene, 1-(bromomethyl)-2-chloro-3-(trifluoromethyl)-
CAS Number:
261763-22-8
Molecular Formula:
C8H5BrClF3
Molecular Weight:
273.4775
MDL Number:
MFCD01631539
IUPAC Name:
1-(bromomethyl)-2-chloro-3-(trifluoromethyl)benzene
InChI:
InChI=1S/C8H5BrClF3/c9-4-5-2-1-3-6(7(5)10)8(11,12)13/h1-3H,4H2
InChI Key:
ZPHUUSQDKIEPDN-UHFFFAOYSA-N
SMILES:
BrCc1cccc(c1Cl)C(F)(F)F
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.922g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.477g/mol
Monoisotopic Mass:
271.922g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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