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Home > Bromides > 1261512-49-5
1261512-49-5 | Benzene, 4-bromo-2-(difluoromethyl)-1-methoxy-
CAS No: 1261512-49-5 Catalog No: AG000RTE MDL No:
Product Description
Catalog Number:
AG000RTE
Chemical Name:
Benzene, 4-bromo-2-(difluoromethyl)-1-methoxy-
CAS Number:
1261512-49-5
Molecular Formula:
C8H7BrF2O
Molecular Weight:
237.0414
IUPAC Name:
4-bromo-2-(difluoromethyl)-1-methoxybenzene
InChI:
InChI=1S/C8H7BrF2O/c1-12-7-3-2-5(9)4-6(7)8(10)11/h2-4,8H,1H3
InChI Key:
ICCUJGHZHVIYDJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(F)F)Br
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.965g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.044g/mol
Monoisotopic Mass:
235.965g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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