CAS 140-50-1 | Acetamide, N,N'-1,4-phenylenebis- | CAS Number 140-50-1

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140-50-1 | Acetamide, N,N'-1,4-phenylenebis-

CAS No: 140-50-1 Catalog No: AG001BXJ MDL No:MFCD00026142

Product Description

Catalog Number:

AG001BXJ

Chemical Name:

Acetamide, N,N'-1,4-phenylenebis-

CAS Number:

140-50-1

Molecular Formula:

C10H12N2O2

Molecular Weight:

192.2145

MDL Number:

MFCD00026142

IUPAC Name:

N-(4-acetamidophenyl)acetamide

InChI:

InChI=1S/C10H12N2O2/c1-7(13)11-9-3-5-10(6-4-9)12-8(2)14/h3-6H,1-2H3,(H,11,13)(H,12,14)

InChI Key:

KVEDKKLZCJBVNP-UHFFFAOYSA-N

SMILES:

CC(=O)Nc1ccc(cc1)NC(=O)C

EC Number:

205-417-3

UNII:

I96A01798W

NSC Number:

401116

Properties

Complexity:

196

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

192.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

192.218g/mol

Monoisotopic Mass:

192.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8

Literature

Title	Journal
Determination of p-phenylenediamine and its metabolites MAPPD and DAPPD in biological samples using HPLC-DAD and amperometric detection.	Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20090601
Elicitation response characteristics to mono- and to N,N'-diacetyl-para-phenylenediamine.	Contact dermatitis 20080601