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88374-32-7 | Acetamide, N-[5-nitro-2-[(1-phenylethyl)amino]phenyl]-
CAS No: 88374-32-7 Catalog No: AG004MA4 MDL No:
Product Description
Catalog Number:
AG004MA4
Chemical Name:
Acetamide, N-[5-nitro-2-[(1-phenylethyl)amino]phenyl]-
CAS Number:
88374-32-7
Molecular Formula:
C16H17N3O3
Molecular Weight:
299.3245
IUPAC Name:
N-[5-nitro-2-(1-phenylethylamino)phenyl]acetamide
InChI:
InChI=1S/C16H17N3O3/c1-11(13-6-4-3-5-7-13)17-15-9-8-14(19(21)22)10-16(15)18-12(2)20/h3-11,17H,1-2H3,(H,18,20)
InChI Key:
ZKQPMJXJNWLWLY-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(ccc1NC(c1ccccc1)C)[N+](=O)[O-]
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.127g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
299.33g/mol
Monoisotopic Mass:
299.127g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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