2-(3-Methylphenyl)pyrrolidine supplier

Name
2-(3-METHYLPHENYL)PYRROLIDINE
EINECS
CAS No. 72216-05-8
Article Data9
CAS DataBase
Density 0.975 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₅N
Boiling Point 256.7 °C at 760 mmHg
Molecular Weight 161.247
Flash Point 110.5 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms 2-(3-Methylphenyl)pyrrolidine;
PSA 12.03000
LogP 2.74830

2-(3-Methylphenyl)pyrrolidine Specification

This chemical is called Pyrrolidine,2-(3-methylphenyl)-, and its systematic name is 2-(3-methylphenyl)pyrrolidine. With the molecular formula of C₁₁H₁₅N, its molecular weight is 161.24. The CAS registry number of this chemical is 72216-05-8.

Other characteristics of the Pyrrolidine,2-(3-methylphenyl)- can be summarised as followings: (1)ACD/LogP: 2.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.86; (4)ACD/LogD (pH 7.4): -0.66; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å²; (13)Index of Refraction: 1.53; (14)Molar Refractivity: 51.06 cm³; (15)Molar Volume: 165.2 cm³; (16)Polarizability: 20.24×10^-24cm³; (17)Surface Tension: 35.7 dyne/cm; (18)Density: 0.975 g/cm³; (19)Flash Point: 110.5 °C; (20)Enthalpy of Vaporization: 49.42 kJ/mol; (21)Boiling Point: 256.7 °C at 760 mmHg; (22)Vapour Pressure: 0.0152 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: c1c(cc(cc1)C2NCCC2)C
2.InChI: InChI=1/C11H15N/c1-9-4-2-5-10(8-9)11-6-3-7-12-11/h2,4-5,8,11-12H,3,6-7H2,1H3
3.InChIKey: UUTBSNFHBOVJLI-UHFFFAOYAK

Product Name

2-(3-METHYLPHENYL)PYRROLIDINE

2-(3-Methylphenyl)pyrrolidine Specification

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