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Home > Bromides > 1004112-67-7
1004112-67-7 | Benzene, 1-bromo-3-chloro-5-(difluoromethoxy)-
CAS No: 1004112-67-7 Catalog No: AG0001XV MDL No:MFCD18390894
Product Description
Catalog Number:
AG0001XV
Chemical Name:
Benzene, 1-bromo-3-chloro-5-(difluoromethoxy)-
CAS Number:
1004112-67-7
Molecular Formula:
C7H4BrClF2O
Molecular Weight:
257.4599
MDL Number:
MFCD18390894
IUPAC Name:
1-bromo-3-chloro-5-(difluoromethoxy)benzene
InChI:
InChI=1S/C7H4BrClF2O/c8-4-1-5(9)3-6(2-4)12-7(10)11/h1-3,7H
InChI Key:
IVRGKKXJURVLGX-UHFFFAOYSA-N
SMILES:
FC(Oc1cc(Cl)cc(c1)Br)F
EC Number:
600-092-8
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.91g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.459g/mol
Monoisotopic Mass:
255.91g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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