200,000+ products from a single source!
sales@angenechem.com
100948-85-4 | Benzoic acid, 2-amino-4-chloro-5-nitro-
CAS No: 100948-85-4 Catalog No: AG00039Z MDL No:
Product Description
Catalog Number:
AG00039Z
Chemical Name:
Benzoic acid, 2-amino-4-chloro-5-nitro-
CAS Number:
100948-85-4
Molecular Formula:
C7H5ClN2O4
Molecular Weight:
216.5786
IUPAC Name:
2-amino-4-chloro-5-nitrobenzoic acid
InChI:
InChI=1S/C7H5ClN2O4/c8-4-2-5(9)3(7(11)12)1-6(4)10(13)14/h1-2H,9H2,(H,11,12)
InChI Key:
QZHMAYCAKJYUMK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(C(=O)O)c(cc1Cl)N
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.994g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.577g/mol
Monoisotopic Mass:
215.994g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Solid-phase synthesis of 3-hydroxy-6-nitroquinolin-4(1H)-ones with two diversity positions. | Journal of combinatorial chemistry 20090101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.