200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 19005-68-6
19005-68-6 | N-(4-cyano-2-nitrophenyl)glycine
CAS No: 19005-68-6 Catalog No: AG00J8E7 MDL No:MFCD12188660
Product Description
Catalog Number:
AG00J8E7
Chemical Name:
N-(4-cyano-2-nitrophenyl)glycine
CAS Number:
19005-68-6
Molecular Formula:
C9H7N3O4
Molecular Weight:
221.1696
MDL Number:
MFCD12188660
IUPAC Name:
2-(4-cyano-2-nitroanilino)acetic acid
InChI:
InChI=1S/C9H7N3O4/c10-4-6-1-2-7(11-5-9(13)14)8(3-6)12(15)16/h1-3,11H,5H2,(H,13,14)
InChI Key:
IDALYWATMXCOCC-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)[N+](=O)[O-])NCC(=O)O
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.044g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.172g/mol
Monoisotopic Mass:
221.044g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.