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124264-90-0

124264-90-0 | Benzamide, 2-nitro-N-(1-phenylethyl)-

CAS No: 124264-90-0 Catalog No: AG000LRO MDL No:MFCD00423615

Product Description

Catalog Number:
AG000LRO
Chemical Name:
Benzamide, 2-nitro-N-(1-phenylethyl)-
CAS Number:
124264-90-0
Molecular Formula:
C15H14N2O3
Molecular Weight:
270.2833
MDL Number:
MFCD00423615
IUPAC Name:
2-nitro-N-(1-phenylethyl)benzamide
InChI:
InChI=1S/C15H14N2O3/c1-11(12-7-3-2-4-8-12)16-15(18)13-9-5-6-10-14(13)17(19)20/h2-11H,1H3,(H,16,18)
InChI Key:
TYMCJGBVKJRKCM-UHFFFAOYSA-N
SMILES:
CC(c1ccccc1)NC(=O)c1ccccc1[N+](=O)[O-]

Properties

Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.1g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
270.288g/mol
Monoisotopic Mass:
270.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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