N-Methyl-p-phenylenediamine - CAS 623-09-6

Catalog:	BB031521
Product Name:	N-Methyl-p-phenylenediamine
CAS:	623-09-6
Synonyms:	N4-methylbenzene-1,4-diamine; 4-N-methylbenzene-1,4-diamine

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	4-N-methylbenzene-1,4-diamine
Description:	N-Methyl-p-phenylenediamine (CAS# 623-09-6) is a useful research chemical.
Molecular Weight:	122.17
Molecular Formula:	C7H10N2
Canonical SMILES:	CNC1=CC=C(C=C1)N
InChI:	InChI=1S/C7H10N2/c1-9-7-4-2-6(8)3-5-7/h2-5,9H,8H2,1H3
InChI Key:	VVYWUQOTMZEJRJ-UHFFFAOYSA-N
Boiling Point:	257 °C
Density:	1.098 g/cm³
Appearance:	Light yellow to brown liquid
LogP:	1.96470

Publication Number	Title	Priority Date
CN-112778172-A	Novel brilliant blue dye intermediate, reactive brilliant blue dye and preparation method and application thereof	20201231
KR-102223332-B1	Hair-dye composition comprising liposome packed L-arginie and organic fatty acids	20201028
KR-102193192-B1	Dye and manufacturing method thereof	20200914
KR-102238886-B1	Oxidative hair dye composition with gel type	20200413
WO-2021199659-A1	Composite semipermeable membrane	20200331

PMID	Publication Date	Title	Journal
20855103	20101101	Biological transformation pathways of 2,4-dinitro anisole and N-methyl paranitro aniline in anaerobic fluidized-bed bioreactors	Chemosphere

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Related Functional Groups

Amines and Anilines

[556-90-1]
Pseudothiohydantoin
[932890-93-2]
1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine
[1431965-90-0]
1-Cyclopentyl-5-methylpyrazol-3-amine hydrochloride
[17583-40-3]
2-(Methylamino)benzonitrile
[42150-24-3]
2-(4-Pyrazolyl)ethylamine
[6397-33-7]
2-(Isopropylthio)aniline

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	75
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	122.084398327
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	122.084398327
Rotatable Bond Count:	1
Topological Polar Surface Area:	38 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5