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74993-03-6

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Basic Information
CAS No.: 74993-03-6
Name: gamma-methylaziridine-1-propylamine
Molecular Structure:
Molecular Structure of 74993-03-6 (gamma-methylaziridine-1-propylamine)
Formula: C6H14N2
Molecular Weight: 114.18876
Synonyms: 3-(Aziridin-1-yl)butan-1-amine;
EINECS: 278-047-3
Density: 0.979 g/cm3
Boiling Point: 165.61 °C at 760 mmHg
Flash Point: 50.361 °C
PSA: 29.03000
LogP: 0.67750
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Specification

The 1-Aziridinepropanamine,g-methyl-, with the CAS registry number 74993-03-6, is also known as gamma-Methylaziridine-1-propylamine. Its EINECS registry number is 278-047-3. This chemical's molecular formula is C6H14N2 and molecular weight is 114.18876. What's more, both its IUPAC name and systematic name are the same which is called 3-(Aziridin-1-yl)butan-1-amine.

Physical properties about 1-Aziridinepropanamine,g-methyl- are: (1)ACD/LogP: -0.46; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 29.03 Å2; (7)Index of Refraction: 1.509; (8)Molar Refractivity: 34.823 cm3; (9)Molar Volume: 116.597 cm3; (10)Surface Tension: 40.82 dyne/cm; (11)Density: 0.979 g/cm3; (12)Flash Point: 50.361 °C; (13)Enthalpy of Vaporization: 40.21 kJ/mol; (14)Boiling Point: 165.61 °C at 760 mmHg; (15)Vapour Pressure: 1.858 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: NCCC(N1CC1)C
(2) InChI: InChI=1/C6H14N2/c1-6(2-3-7)8-4-5-8/h6H,2-5,7H2,1H3
(3) InChIKey: SVXZTUWVVQGRPC-UHFFFAOYAB