200,000+ products from a single source!
sales@angenechem.com
1167056-67-8 | Benzoic acid, 2-amino-4-bromo-6-nitro-
CAS No: 1167056-67-8 Catalog No: AG000D3R MDL No:
Product Description
Catalog Number:
AG000D3R
Chemical Name:
Benzoic acid, 2-amino-4-bromo-6-nitro-
CAS Number:
1167056-67-8
Molecular Formula:
C7H5BrN2O4
Molecular Weight:
261.0296
IUPAC Name:
2-amino-4-bromo-6-nitrobenzoic acid
InChI:
InChI=1S/C7H5BrN2O4/c8-3-1-4(9)6(7(11)12)5(2-3)10(13)14/h1-2H,9H2,(H,11,12)
InChI Key:
LVSDQVYGRCBVCK-UHFFFAOYSA-N
SMILES:
Brc1cc(N)c(c(c1)[N+](=O)[O-])C(=O)O
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.943g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
261.031g/mol
Monoisotopic Mass:
259.943g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.