Pyrrolidine, 3,3-dimethyl- supplier

Name
3,3-DIMETHYLPYRROLIDINE
EINECS
CAS No. 3437-30-7
Article Data8
CAS DataBase
Density 0.805 g/cm³
Solubility
Melting Point
Formula C₆H₁₃N
Boiling Point 107.406 °C at 760 mmHg
Molecular Weight 99.1759
Flash Point 5.478 °C
Transport Information
Appearance
Safety
Risk Codes 22
Molecular Structure
Hazard Symbols Xi
Synonyms 3,3-Dimethylpyrrolidine;
PSA 12.03000
LogP 1.33470

Pyrrolidine, 3,3-dimethyl- Specification

The Pyrrolidine, 3,3-dimethyl- has the CAS registry number 3437-30-7. This chemical's molecular formula is C₆H₁₃N and molecular weight is 163.99. What's more, its systematic name is 3,3-dimethylpyrrolidine.

Physical properties of Pyrrolidine, 3,3-dimethyl- are: (1)ACD/LogP: 1.00; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/KOC (pH 5.5): 1; (5)#H bond acceptors: 1; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 12.03 Å²; (9)Index of Refraction: 1.419; (10)Molar Refractivity: 31.116 cm³; (11)Molar Volume: 123.164 cm³; (12)Surface Tension: 25.232 dyne/cm; (13)Density: 0.805 g/cm³; (14)Flash Point: 5.478 °C; (15)Enthalpy of Vaporization: 34.626 kJ/mol; (16)Boiling Point: 107.406 °C at 760 mmHg; (17)Vapour Pressure: 27.109 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC1(C)CCNC1
(2)InChI: InChI=1S/C6H13N/c1-6(2)3-4-7-5-6/h7H,3-5H2,1-2H3
(3)InChIKey: XBQNZPDIRJPFAI-UHFFFAOYSA-N

Product Name

3,3-DIMETHYLPYRROLIDINE

Pyrrolidine, 3,3-dimethyl- Specification

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