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CAS No.: | 383127-30-8 |
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Name: | 2-(2,3-dichlorophenyl)pyrrolidine |
Molecular Structure: | |
Formula: | C10H11Cl2N |
Molecular Weight: | 216.11 |
Synonyms: | 2-(2,3-Dichlorophenyl)pyrrolidine; |
Density: | 1.25 g/cm3 |
Boiling Point: | 284.9 °C at 760 mmHg |
Flash Point: | 126.1 °C |
PSA: | 12.03000 |
LogP: | 3.74670 |
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The Pyrrolidine, 2-(2, 3-dichlorophenyl)- has CAS registry number 383127-30-8. This chemical's molecular formula is C10H11Cl2N and molecular weight is 216.11. What's more, its systematic name is 2-(2, 3-Dichlorophenyl)pyrrolidine.
Physical properties about Pyrrolidine, 2-(2, 3-dichlorophenyl)- are: (1)ACD/LogP: 2.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.23; (4)ACD/LogD (pH 7.4): 0.49; (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): 3.69; (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: 1.561; (14)Molar Refractivity: 56.02 cm3; (15)Molar Volume: 172.8 cm3; (16)Polarizability: 22.21×10-24 cm3; (17)Surface Tension: 41.2 dyne/cm; (18)Density: 1.25 g/cm3; (19)Flash Point: 126.1 °C; (20)Enthalpy of Vaporization: 52.4 kJ/mol; (21)Boiling Point: 284.9 °C at 760 mmHg; (22)Vapour Pressure: 0.00289 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Clc1cccc(c1Cl)C2NCCC2
(2) InChI: InChI=1/C10H11Cl2N/c11-8-4-1-3-7(10(8)12)9-5-2-6-13-9/h1,3-4,9,13H,2,5-6H2
(3) InChIKey: HZVTWBMAMRYGPD-UHFFFAOYAH