200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 499986-39-9
499986-39-9 | 4-Nitro-N-(4-nitro-benzyl)-N-phenyl-benzamide
CAS No: 499986-39-9 Catalog No: AG01EW6J MDL No:
Product Description
Catalog Number:
AG01EW6J
Chemical Name:
4-Nitro-N-(4-nitro-benzyl)-N-phenyl-benzamide
CAS Number:
499986-39-9
Molecular Formula:
C20H15N3O5
Molecular Weight:
377.3502
IUPAC Name:
4-nitro-N-[(4-nitrophenyl)methyl]-N-phenylbenzamide
InChI:
InChI=1S/C20H15N3O5/c24-20(16-8-12-19(13-9-16)23(27)28)21(17-4-2-1-3-5-17)14-15-6-10-18(11-7-15)22(25)26/h1-13H,14H2
InChI Key:
JCSUQPKIRAPLAV-UHFFFAOYSA-N
SMILES:
O=C(N(c1ccccc1)Cc1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
551
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.101g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
377.356g/mol
Monoisotopic Mass:
377.101g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.