200,000+ products from a single source!
sales@angenechem.com
86405-19-8 | Benzoic acid, 3-(acetylamino)-, 4-nitrophenyl ester
CAS No: 86405-19-8 Catalog No: AG004NMJ MDL No:
Product Description
Catalog Number:
AG004NMJ
Chemical Name:
Benzoic acid, 3-(acetylamino)-, 4-nitrophenyl ester
CAS Number:
86405-19-8
Molecular Formula:
C15H12N2O5
Molecular Weight:
300.2662
IUPAC Name:
(4-nitrophenyl) 3-acetamidobenzoate
InChI:
InChI=1S/C15H12N2O5/c1-10(18)16-12-4-2-3-11(9-12)15(19)22-14-7-5-13(6-8-14)17(20)21/h2-9H,1H3,(H,16,18)
InChI Key:
WSJLWGBDMVVKIR-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cccc(c1)C(=O)Oc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
426
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.075g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
300.27g/mol
Monoisotopic Mass:
300.075g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.