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Home > Nitro Compounds > 1613-80-5
1613-80-5 | Benzamide, 4-nitro-N-(phenylmethoxy)-
CAS No: 1613-80-5 Catalog No: AG001SBY MDL No:
Product Description
Catalog Number:
AG001SBY
Chemical Name:
Benzamide, 4-nitro-N-(phenylmethoxy)-
CAS Number:
1613-80-5
Molecular Formula:
C14H12N2O4
Molecular Weight:
272.2561
IUPAC Name:
4-nitro-N-phenylmethoxybenzamide
InChI:
InChI=1S/C14H12N2O4/c17-14(12-6-8-13(9-7-12)16(18)19)15-20-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,15,17)
InChI Key:
IGYAERYHRSHDTR-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)[N+](=O)[O-])NOCc1ccccc1
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.08g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.26g/mol
Monoisotopic Mass:
272.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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