CAS No.67318-88-1,3-Pyrrolidinemethanamine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	67318-88-1
Name:	3-Pyrrolidinemethanamine

Formula:	C₅H₁₂N₂
Molecular Weight:	100.16
Synonyms:	Pyrrolidine,3-(aminomethyl)- (7CI);(Pyrrolidin-3-ylmethyl)amine;3-Aminomethylpyrrolidine;3-Pyrrolidinemethylamine;
Density:	0.914 g/cm³
Boiling Point:	163.7 °C at 760 mmHg
Flash Point:	56.9 °C
PSA:	38.05000
LogP:	0.58370

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Specification

The 3-Pyrrolidinemethanamine with the CAS number 67318-88-1 is also called Pyrrolidine,3-(aminomethyl)- (7CI). The systematic name is 1-pyrrolidin-3-ylmethanamine. Its molecular formula is C₅H₁₂N₂. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 3-Pyrrolidinemethanamine are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 38.05Å²; (10)Index of Refraction: 1.46; (11)Molar Refractivity: 30.02 cm³; (12)Molar Volume: 109.4 cm³; (13)Polarizability: 11.9×10^-24cm³; (14)Surface Tension: 35 dyne/cm; (15)Enthalpy of Vaporization: 40.02 kJ/mol; (16)Vapour Pressure: 2.04 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: NCC1CCNC1
(2)InChI: InChI=1/C5H12N2/c6-3-5-1-2-7-4-5/h5,7H,1-4,6H2
(3)InChIKey: OQCUGPQOZNYIMV-UHFFFAOYAD