CAS No.25265-76-3,PHENYLENDIAMINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	25265-76-3
Name:	PHENYLENDIAMINE

Formula:	C₆H₈N₂
Molecular Weight:	108.14292
Synonyms:	Phenylenediamine(8CI);Bant;Benzenamine, ar-amino-;Benzene, diamino-;Diaminobenzene;
EINECS:	202-430-6
Density:	1.15 g/cm³
Melting Point:	62-63oC
Boiling Point:	257 °C at 760 mmHg
Flash Point:	124.9 °C
PSA:	52.04000
LogP:	2.01340

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Specification

The CAS register number of Benzenediamine is 25265-76-3. It also can be called as Diaminobenzene and the systematic name about this chemical is benzene-1,2-diamine. The molecular formula about this chemical is C₆H₈N₂ and the molecular weight is 108.14292.

Physical properties about Benzenediamine are: (1)ACD/LogP: 0.05; (2)ACD/LogD (pH 5.5): 0.01; (3)ACD/LogD (pH 7.4): 0.05; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 23.31; (7)ACD/KOC (pH 7.4): 25.41; (8)#H bond acceptors: 2; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 52.04 Å²; (12)Index of Refraction: 1.66; (13)Molar Refractivity: 34.72 cm³; (14)Molar Volume: 93.9 cm³; (15)Polarizability: 13.76x10^-24cm³; (16)Surface Tension: 57.5 dyne/cm; (17)Density: 1.15 g/cm³; (18)Flash Point: 124.9 °C; (19)Enthalpy of Vaporization: 49.45 kJ/mol; (20)Boiling Point: 257 °C at 760 mmHg; (21)Vapour Pressure: 0.0149 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Nc1ccccc1N
(2)InChI: InChI=1/C6H8N2/c7-5-3-1-2-4-6(5)8/h1-4H,7-8H2
(3)InChIKey: GEYOCULIXLDCMW-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C6H8N2/c7-5-3-1-2-4-6(5)8/h1-4H,7-8H2
(5)Std. InChIKey: GEYOCULIXLDCMW-UHFFFAOYSA-N