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1150617-53-0 | BenzenaMine, 3-broMo-N-Methyl-2-nitro-
CAS No: 1150617-53-0 Catalog No: AG000FTN MDL No:MFCD12024389
Product Description
Catalog Number:
AG000FTN
Chemical Name:
BenzenaMine, 3-broMo-N-Methyl-2-nitro-
CAS Number:
1150617-53-0
Molecular Formula:
C7H7BrN2O2
Molecular Weight:
231.0467
MDL Number:
MFCD12024389
IUPAC Name:
3-bromo-N-methyl-2-nitroaniline
InChI:
InChI=1S/C7H7BrN2O2/c1-9-6-4-2-3-5(8)7(6)10(11)12/h2-4,9H,1H3
InChI Key:
CSEVRXHXBSVRQN-UHFFFAOYSA-N
SMILES:
CNc1cccc(c1[N+](=O)[O-])Br
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.969g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.049g/mol
Monoisotopic Mass:
229.969g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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