Name: N-(2-AMINOPHENYL)-N-CYCLOHEXYLAMINE
SKU: 74628-31-2

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Basic Information

Molecular Structure:
CAS No.:	74628-31-2
Name:	N-(2-AMINOPHENYL)-N-CYCLOHEXYLAMINE
Article Data:	21

Formula:	C₁₂H₁₈N₂
Molecular Weight:	190.288
Synonyms:	1,2-Benzenediamine,N-cyclohexyl- (9CI);o-Phenylenediamine, N-cyclohexyl- (6CI,7CI);N-Cyclohexylo-phenylenediamine;N-Cyclohexylbenzene-1,2-diamine;
Density:	1.095 g/cm³
Boiling Point:	344.5 °C at 760 mmHg
Flash Point:	190.3 °C
PSA:	38.05000
LogP:	3.66760

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Specification

This chemical is called 1,2-Benzenediamine,N¹-cyclohexyl-, and its systematic name is N-cyclohexylbenzene-1,2-diamine. With the molecular formula of C₁₂H₁₈N₂, its molecular weight is 190.28. The CAS registry number of this chemical is 74628-31-2.

Other characteristics of the 1,2-Benzenediamine,N¹-cyclohexyl- can be summarised as followings: (1)ACD/LogP: 2.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.63; (4)ACD/LogD (pH 7.4): 2.64; (5)ACD/BCF (pH 5.5): 5.61; (6)ACD/BCF (pH 7.4): 58.24; (7)ACD/KOC (pH 5.5): 59.24; (8)ACD/KOC (pH 7.4): 614.98; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.621; (14)Molar Refractivity: 61.13 cm³; (15)Molar Volume: 173.6 cm³; (16)Polarizability: 24.23×10^-24cm³; (17)Surface Tension: 48.9 dyne/cm; (18)Density: 1.095 g/cm³; (19)Flash Point: 190.3 °C; (20)Enthalpy of Vaporization: 58.85 kJ/mol; (21)Boiling Point: 344.5 °C at 760 mmHg; (22)Vapour Pressure: 6.55E-05 mmHg at 25°C. g/cm³.

You can still convert the following datas into molecular structure:
1.SMILES: c2(c(NC1CCCCC1)cccc2)N
2.InChI: InChI=1/C12H18N2/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h4-5,8-10,14H,1-3,6-7,13H2
3.InChIKey: YQACKMXMLJSWFM-UHFFFAOYAN