Benzenamine,2-(1-piperazinyl)- supplier

Name
2-PIPERAZIN-1-YL-PHENYLAMINE
EINECS
CAS No. 13339-02-1
Article Data3
CAS DataBase
Density 1.107g/cm³
Solubility
Melting Point 110 °C
Formula C₁₀H₁₅N₃
Boiling Point 344.846 °C at 760 mmHg
Molecular Weight 177.249
Flash Point 162.358 °C
Transport Information
Appearance
Safety 26
Risk Codes 36
Molecular Structure
Hazard Symbols
Synonyms 1-(2-Aminophenyl)piperazine;NSC 285885;Piperazine,1-(o-aminophenyl)- (8CI);
PSA 41.29000
LogP 1.65340

Benzenamine,2-(1-piperazinyl)- Specification

The Benzenamine,2-(1-piperazinyl)-, with CAS registry number 13339-02-1, belongs to the following product category: Piperidine. It has the systematic name of 2-(piperazin-1-yl)aniline. Besides this, it is also called 2-Piperazin-1-yl-phenylamine. And the chemical formula of this chemical is C₁₀H₁₅N₃.

Physical properties of Benzenamine,2-(1-piperazinyl)-: (1)ACD/LogP: 1.50; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 2.954; (7)#H bond acceptors: 3; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 41.29 Å²; (11)Index of Refraction: 1.591; (12)Molar Refractivity: 54.042 cm³; (13)Molar Volume: 160.015 cm³; (14)Polarizability: 21.424×10^-24cm³; (15)Surface Tension: 46.09 dyne/cm; (16)Density: 1.108 g/cm³; (17)Flash Point: 162.358 °C; (18)Enthalpy of Vaporization: 58.885 kJ/mol; (19)Boiling Point: 344.846 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(c(c1)N)N2CCNCC2
(2)InChI: InChI=1/C10H15N3/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8,11H2
(3)InChIKey: TZWRXFPFRACRLO-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C10H15N3/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8,11H2
(5)Std. InChIKey: TZWRXFPFRACRLO-UHFFFAOYSA-N

Product Name

2-PIPERAZIN-1-YL-PHENYLAMINE

Benzenamine,2-(1-piperazinyl)- Specification

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