200,000+ products from a single source!
sales@angenechem.com
1260848-51-8 | Benzoic acid, 4-amino-2-methyl-5-nitro-, methyl ester
CAS No: 1260848-51-8 Catalog No: AG000RFF MDL No:MFCD08458965
Product Description
Catalog Number:
AG000RFF
Chemical Name:
Benzoic acid, 4-amino-2-methyl-5-nitro-, methyl ester
CAS Number:
1260848-51-8
Molecular Formula:
C9H10N2O4
Molecular Weight:
210.1867
MDL Number:
MFCD08458965
IUPAC Name:
methyl 4-amino-2-methyl-5-nitrobenzoate
InChI:
InChI=1S/C9H10N2O4/c1-5-3-7(10)8(11(13)14)4-6(5)9(12)15-2/h3-4H,10H2,1-2H3
InChI Key:
JWLVSMLOEYNNHO-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc([N+](=O)[O-])c(cc1C)N
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.064g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.189g/mol
Monoisotopic Mass:
210.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
98.1A^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.