3-Phenoxy-azetidinehydrochloride supplier

Name
3-Phenoxy-azetidinehydrochloride
EINECS
CAS No. 301335-39-7
Article Data2
CAS DataBase
Density
Solubility
Melting Point
Formula C₉H₁₂ClNO
Boiling Point 276.7 °C at 760 mmHg
Molecular Weight 185.653
Flash Point 121.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Azetidine, 3-phenoxy-, hydrochloride (1:1);
PSA 21.26000
LogP 2.16800

3-Phenoxy-azetidinehydrochloride Specification

The 3-Phenoxy-azetidinehydrochloride, with the CAS registry number 301335-39-7, is also known as Azetidine, 3-phenoxy-, hydrochloride (1:1). This chemical's molecular formula is C₉H₁₂ClNO and molecular weight is 185.6507. What's more, its systematic name is called 3-Phenoxyazetidine hydrochloride.

Physical properties about 3-Phenoxy-azetidinehydrochloride are: (1)ACD/LogP: 1.22; (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): 2; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 21.26 Å²; (11)Flash Point: 121.2 °C; (12)Enthalpy of Vaporization: 52.56 kJ/mol; (13)Boiling Point: 276.7 °C at 760 mmHg; (14)Vapour Pressure: 0.00364 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Cl.c2ccc(OC1CNC1)cc2
(2) InChI: InChI=1/C9H11NO.ClH/c1-2-4-8(5-3-1)11-9-6-10-7-9;/h1-5,9-10H,6-7H2;1H
(3) InChIKey: BDSCNJYDEAUDGY-UHFFFAOYAP

Product Name

3-Phenoxy-azetidinehydrochloride

3-Phenoxy-azetidinehydrochloride Specification

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