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87740-09-8

87740-09-8 | Benzamide, 4-[(4-nitrophenoxy)methyl]-

CAS No: 87740-09-8 Catalog No: AG004G7C MDL No:

Product Description

Catalog Number:
AG004G7C
Chemical Name:
Benzamide, 4-[(4-nitrophenoxy)methyl]-
CAS Number:
87740-09-8
Molecular Formula:
C14H12N2O4
Molecular Weight:
272.2561
IUPAC Name:
4-[(4-nitrophenoxy)methyl]benzamide
InChI:
InChI=1S/C14H12N2O4/c15-14(17)11-3-1-10(2-4-11)9-20-13-7-5-12(6-8-13)16(18)19/h1-8H,9H2,(H2,15,17)
InChI Key:
XOPUSUVKWGTQPF-UHFFFAOYSA-N
SMILES:
NC(=O)c1ccc(cc1)COc1ccc(cc1)[N+](=O)[O-]

Properties

Complexity:
340  
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:
98.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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