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CAS No.: | 13220-27-4 |
---|---|
Name: | 1-Methylpyrrolidin-3-amine |
Molecular Structure: | |
Formula: | C5H12N2 |
Molecular Weight: | 100.164 |
Synonyms: | ALINDA 1242; |
Density: | 0.933 g/cm3 |
Boiling Point: | 109.63 °C at 760 mmHg |
Flash Point: | 22.382 °C |
Hazard Symbols: | Xi |
PSA: | 29.26000 |
LogP: | 0.28740 |
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The CAS register number of 1-Methylpyrrolidin-3-amine is 13220-27-4. The molecular formula about this chemical is C5H12N2 and the molecular weight is 100.16368. This chemical is irritant. It may cause inflammation to the skin or other mucous membranes.
Physical properties about 1-Methylpyrrolidin-3-amine are: (1)ACD/LogP: 0.68; (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: 2; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 29.26 Å2; (10)Index of Refraction: 1.476; (11)Molar Refractivity: 30.274 cm3; (12)Molar Volume: 107.342 cm3; (13)Polarizability: 12.002x10-24cm3; (14)Surface Tension: 31.67 dyne/cm; (15)Density: 0.933 g/cm3; (16)Flash Point: 22.382 °C; (17)Enthalpy of Vaporization: 34.835 kJ/mol; (18)Boiling Point: 109.63 °C at 760 mmHg; (19)Vapour Pressure: 24.597 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: NC1CCN(C)C1
(2)InChI: InChI=1/C5H12N2/c1-7-3-2-5(6)4-7/h5H,2-4,6H2,1H3
(3)InChIKey: UNHOPMIDKWXFMF-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C5H12N2/c1-7-3-2-5(6)4-7/h5H,2-4,6H2,1H3
(5)Std. InChIKey: UNHOPMIDKWXFMF-UHFFFAOYSA-N