3-Pyrrolidinamine,1-methyl-, (3S)- supplier

Name
3-Pyrrolidinamine,1-methyl-,(3S)-(9CI)
EINECS
CAS No. 214357-95-6
Density 0.933 g/cm³
Solubility
Melting Point
Formula C₅H₁₂N₂
Boiling Point 109.63 °C at 760 mmHg
Molecular Weight 100.164
Flash Point 22.382 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (3S)-1-Methylpyrrolidin-3-amine;
PSA 29.26000
LogP 0.28740

3-Pyrrolidinamine,1-methyl-, (3S)- Specification

The 3-Pyrrolidinamine,1-methyl-, (3S)-, with the CAS registry number 214357-95-6, is also known as (S)-1-Methylpyrrolidin-3-amine. It belongs to the product category of Variousamine. This chemical's molecular formula is C₅H₁₂N₂ and molecular weight is 100.1622. What's more, both its IUPAC name and systematic name are the same which is called (3S)-1-Methylpyrrolidin-3-amine.

Physical properties about 3-Pyrrolidinamine,1-methyl-, (3S)- are: (1)ACD/LogP: 0.68; (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): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 29.26 Å²; (11)Index of Refraction: 1.476; (12)Molar Refractivity: 30.274 cm³; (13)Molar Volume: 107.342 cm³; (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: CN1CC[C@@H](C1)N
(2) InChI: InChI=1/C5H12N2/c1-7-3-2-5(6)4-7/h5H,2-4,6H2,1H3/t5-/m0/s1
(3) InChIKey: UNHOPMIDKWXFMF-YFKPBYRVBI

Product Name

3-Pyrrolidinamine,1-methyl-,(3S)-(9CI)

3-Pyrrolidinamine,1-methyl-, (3S)- Specification

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