CAS No.105-10-2,DIMETHYL-PARA-PHENYLENEDIAMINEHYDROCHLORIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	105-10-2
Name:	DIMETHYL-PARA-PHENYLENEDIAMINEHYDROCHLORIDE
Article Data:	17

Formula:	C8H12 N2
Molecular Weight:	136.197
Synonyms:	1,4-Benzenediamine,N,N'-dimethyl- (9CI); p-Phenylenediamine, N,N'-dimethyl- (7CI,8CI); Alarmine;N,N'-Dimethyl-1,4-phenylenediamine; N,N'-Dimethyl-p-phenylenediamine;N,N'-Dimethylbenzene-1,4-diamine
Density:	g/cm³
Melting Point:	53°C
Boiling Point:	262°Cat760mmHg
Flash Point:	88.6°C
Safety:	Poison by intraperitoneal route. Mutation data reported. When heated to decomposition it emits toxic fumes of NO_x.
PSA:	24.06000
LogP:	1.91600

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Chemistry

Molecule structure of N,N-Dimethyl-1,4-benzenediamine (CAS NO.105-10-2):

IUPAC Name: 1-N,1-N-Dimethylbenzene-1,4-diamine hydrochloride
Molecular Weight: 172.65522 g/mol
Molecular Formula: C₈H₁₃ClN₂
Boiling Point: 262 °C at 760 mmHg
Flash Point: 88.6 °C
Enthalpy of Vaporization: 49.98 kJ/mol
Vapour Pressure: 0.0112 mmHg at 25 °C
H-Bond Donor: 2
H-Bond Acceptor: 2
Rotatable Bond Count: 1
Exact Mass: 172.076726
MonoIsotopic Mass: 172.076726
Topological Polar Surface Area: 29.3
Heavy Atom Count: 11
Complexity: 93.4
Canonical SMILES: CN(C)C1=CC=C(C=C1)N.Cl
InChI: InChI=1S/C8H12N2.ClH/c1-10(2)8-5-3-7(9)4-6-8;/h3-6H,9H2,1-2H3;1H
InChIKey of N,N-Dimethyl-1,4-benzenediamine (CAS NO.105-10-2): KTWNIUBGGFBRKH-UHFFFAOYSA-N

Toxicity Data With Reference

1.	mma-sat 5 µg/plate	AEMIDF Applied and Environmental Microbiology. 42 (1981),641.
2.	dns-rat:lvr 100 µmol/L	MUREAV Mutation Research. 135 (1984),255.
3.	dns-ham:lvr 100 µmol/L	MUREAV Mutation Research. 135 (1984),255.
4.	ipr-rat LD50:21 mg/kg	JPETAB Journal of Pharmacology and Experimental Therapeutics. 95 (1949),262.
5.	ipr-mus LD50:25 mg/kg	JPETAB Journal of Pharmacology and Experimental Therapeutics. 95 (1949),262.
6.	ipr-dog LDLo:10 mg/kg	JPETAB Journal of Pharmacology and Experimental Therapeutics. 95 (1949),262.
7.	ipr-rbt LD50:100 mg/kg	JPETAB Journal of Pharmacology and Experimental Therapeutics. 95 (1949),262.
8.	ipr-gpg LD50:45 mg/kg	JPETAB Journal of Pharmacology and Experimental Therapeutics. 95 (1949),262.

Safety Profile

Poison by intraperitoneal route. Mutation data reported. When heated to decomposition it emits toxic fumes of NO_x.

Specification

N,N-Dimethyl-1,4-benzenediamine (CAS NO.105-10-2) is also named as AI3-52362 ; 1,4-Benzenediamine, N,N'-dimethyl- ; 1,4-Benzenediamine, N,N-dimethyl-, monohydrochloride .