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Home > Nitro Compounds > 75990-88-4
75990-88-4 | Acetamide, N-methyl-N-(4-nitrophenyl)-2-(phenylthio)-
CAS No: 75990-88-4 Catalog No: AG005SF4 MDL No:
Product Description
Catalog Number:
AG005SF4
Chemical Name:
Acetamide, N-methyl-N-(4-nitrophenyl)-2-(phenylthio)-
CAS Number:
75990-88-4
Molecular Formula:
C15H14N2O3S
Molecular Weight:
302.3483
IUPAC Name:
N-methyl-N-(4-nitrophenyl)-2-phenylsulfanylacetamide
InChI:
InChI=1S/C15H14N2O3S/c1-16(12-7-9-13(10-8-12)17(19)20)15(18)11-21-14-5-3-2-4-6-14/h2-10H,11H2,1H3
InChI Key:
GJMRVGRGEXXCFA-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)[N+](=O)[O-])C(=O)CSc1ccccc1
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.073g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.348g/mol
Monoisotopic Mass:
302.073g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
91.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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