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Home > Bromides > 1261448-85-4
1261448-85-4 | Benzene, 4-bromo-2-(chloromethyl)-1-nitro-
CAS No: 1261448-85-4 Catalog No: AG000RRA MDL No:MFCD18392297
Product Description
Catalog Number:
AG000RRA
Chemical Name:
Benzene, 4-bromo-2-(chloromethyl)-1-nitro-
CAS Number:
1261448-85-4
Molecular Formula:
C7H5BrClNO2
Molecular Weight:
250.4771
MDL Number:
MFCD18392297
IUPAC Name:
4-bromo-2-(chloromethyl)-1-nitrobenzene
InChI:
InChI=1S/C7H5BrClNO2/c8-6-1-2-7(10(11)12)5(3-6)4-9/h1-3H,4H2
InChI Key:
SFDHDGLTHCTLEF-UHFFFAOYSA-N
SMILES:
ClCc1cc(Br)ccc1[N+](=O)[O-]
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.919g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.476g/mol
Monoisotopic Mass:
248.919g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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