CAS No.617718-46-4,3-FLUOROAZETIDINE HYDROCHLORIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	617718-46-4
Name:	3-FLUOROAZETIDINE HYDROCHLORIDE

Formula:	C₃H₇ClFN
Molecular Weight:	111.55
Synonyms:	Azetidine,3-fluoro-, hydrochloride (9CI);3-Fluoroazetidine hydrochloride;
Melting Point:	128.0 to 132.0 °C
Boiling Point:	59.3 °C at 760 mmHg
Hazard Symbols:	Xn
Risk Codes:	22
PSA:	12.03000
LogP:	1.05850

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Specification

The Azetidine, 3-fluoro-,hydrochloride (1:1), with the CAS registry number 68585-46-6, is also known as CID10125054. This chemical's molecular formula is C₃H₇ClFN and molecular weight is 111.545783. Its IUPAC name is called 3-fluoroazetidine hydrochloride.

Physical properties of Azetidine, 3-fluoro-,hydrochloride (1:1): (1)ACD/LogP: -0.36; (2)ACD/LogD (pH 5.5): -3; (3)ACD/LogD (pH 7.4): -1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)Enthalpy of Vaporization: 30.19 kJ/mol; (11)Boiling Point: 59.3 °C at 760 mmHg; (12)Vapour Pressure: 202 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1C(CN1)F.Cl
(2)InChI: InChI=1S/C3H6FN.ClH/c4-3-1-5-2-3;/h3,5H,1-2H2;1H
(3)InChIKey: PXFUWRWCKSLCLS-UHFFFAOYSA-N