Name: Name:1,4-BENZENE-D4-DIAMINE
Brand: AABLOCKS
SKU: AA008W2X
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA008W2X

Chemical Name: 1,4-BENZENE-D4-DIAMINE

CAS Number: 119516-83-5

Molecular Formula: C6H4D4N2

Molecular Weight: 112.1658

MDL Number: MFCD00190416

SMILES: c1([2H])c(N)c([2H])c(c(c1[2H])N)[2H]

Properties

Complexity: 54.9

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 8

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 2

Isotope Atom Count: 4

Rotatable Bond Count: 0

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: -0.3

Literature fold

Title: Rapid determination of para-phenylenediamine by gas chromatography-mass spectrometry with selected ion monitoring in henna-containing cosmetic products.

Journal: Journal of chromatography. B, Analytical technologies in the biomedical and life sciences20110615

119516-83-5 | 1,4-BENZENE-D4-DIAMINE