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1-Piperazinepropanamine,hydrochloride (1:3) (52198-67-1)

Identification
Name:1-Piperazinepropanamine,hydrochloride (1:3)
Synonyms:1-Piperazinepropanamine,trihydrochloride (9CI);N-(3-Aminopropyl)piperazine trihydrochloride;
CAS:52198-67-1
Molecular Formula: C7H17N3·3(HCl)
Molecular Weight: 252.61
InChI: InChI=1/C7H17N3.3ClH/c8-2-1-5-10-6-3-9-4-7-10;;;/h9H,1-8H2;3*1H
Molecular Structure: (C7H17N3·3(HCl)) 1-Piperazinepropanamine,trihydrochloride (9CI);N-(3-Aminopropyl)piperazine trihydrochloride;
Properties
Flash Point: 350.5 °C at 760 mmHg
Boiling Point: 350.5 °C at 760 mmHg
Specification:

The N-(3-Aminopropyl)piperazine trihydrochloride, with the CAS registry number 52198-67-1, is also known as1-Piperazinepropanamine, hydrochloride (1:3). It belongs to the product category of API Intermediates. This chemical's molecular formula is C7H17N3·3(HCl) and molecular weight is 252.61. What's more, both its IUPAC name and systematic name are the same which is called 3-Piperazin-1-ylpropan-1-amine trihydrochloride.

Physical properties about N-(3-Aminopropyl)piperazine trihydrochloride are: (1) # of Rule of 5 Violations: 0; (2) #H bond acceptors: 3; (3) #H bond donors: 3; (4) #Freely Rotating Bonds: 4; (5) Polar Surface Area: 41.29 Å2; (6) Flash Point: 165.8 °C; (7) Enthalpy of Vaporization: 60.69 kJ/mol; (8) Boiling Point: 350.5 °C at 760 mmHg; (9) Vapour Pressure: 3.08E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Cl.Cl.Cl.NCCCN1CCNCC1
(2) InChI: InChI=1/C7H17N3.3ClH/c8-2-1-5-10-6-3-9-4-7-10;;;/h9H,1-8H2;3*1H
(3) InChIKey: KGDFJVDYTJSSPC-UHFFFAOYAF

Flash Point: 350.5 °C at 760 mmHg
Safety Data