Methyl (Z)-2-[(2,5-dimethylpyrrolidin-1-yl)methyl]-3-phenyl-prop-2-enoate supplier

Name
methyl (2Z)-2-[(2,5-dimethylpyrrolidin-1-yl)methyl]-3-phenylprop-2-enoate
EINECS
CAS No. 53059-68-0
Density 1.041 g/cm³
Solubility
Melting Point
Formula C₁₇H₂₃NO₂
Boiling Point 391.6 °C at 760 mmHg
Molecular Weight 273.37
Flash Point 132.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (2Z)-2-[(2, 5-Dimethylpyrrolidin-1-yl)methyl]-3-phenylprop-2-enoate;
PSA
LogP

Methyl (Z)-2-[(2,5-dimethylpyrrolidin-1-yl)methyl]-3-phenyl-prop-2-enoate Specification

The Methyl (Z)-2-[(2, 5-dimethylpyrrolidin-1-yl)methyl]-3-phenyl-prop-2-enoate has CAS registry number 53059-68-0. This chemical's molecular formula is C₁₇H₂₃NO₂ and molecular weight is 273.37. What's more, its IUPAC name is methyl (2Z)-2-[(2, 5-Dimethylpyrrolidin-1-yl)methyl]-3-phenylprop-2-enoate.

Physical properties about Methyl (Z)-2-[(2, 5-dimethylpyrrolidin-1-yl)methyl]-3-phenyl-prop-2-enoate are: (1)ACD/LogP: 4.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.33; (4)ACD/LogD (pH 7.4): 2.77; (5)ACD/BCF (pH 5.5): 1.21; (6)ACD/BCF (pH 7.4): 33.38; (7)ACD/KOC (pH 5.5): 5.94; (8)ACD/KOC (pH 7.4): 163.45; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.54; (14)Molar Refractivity: 82.46 cm³; (15)Molar Volume: 262.4 cm³; (16)Polarizability: 32.69×10^-24 cm³; (17)Surface Tension: 36.8 dyne/cm; (18)Density: 1.041 g/cm³; (19)Flash Point: 132.9 °C; (20)Enthalpy of Vaporization: 64.12 kJ/mol; (21)Boiling Point: 391.6 °C at 760 mmHg; (22)Vapour Pressure: 2.43E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OC)\C(=C/c1ccccc1)CN2C(CCC2C)C
(2) InChI: InChI=1/C17H23NO2/c1-13-9-10-14(2)18(13)12-16(17(19)20-3)11-15-7-5-4-6-8-15/h4-8,11,13-14H,9-10,12H2,1-3H3/b16-11-
(3) InChIKey: ONXLSGONFRSTPA-WJDWOHSUBH

Product Name

methyl (2Z)-2-[(2,5-dimethylpyrrolidin-1-yl)methyl]-3-phenylprop-2-enoate

Methyl (Z)-2-[(2,5-dimethylpyrrolidin-1-yl)methyl]-3-phenyl-prop-2-enoate Specification

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