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156303-83-2

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Basic Information
CAS No.: 156303-83-2
Name: 1-BENZYLAZETIDIN-3-ONE
Article Data: 2
Molecular Structure:
Molecular Structure of 156303-83-2 (1-BENZYLAZETIDIN-3-ONE)
Formula: C10H11NO
Molecular Weight: 161.203
Synonyms: 1-BENZYLAZETIDIN-3-ONE;1-(Phenylmethyl)-3-azetidinone;1-Benzyl-3-oxoazetidine;3-Azetidinone,1-(phenylMethyl)-
Density: 1.178 g/cm3
Boiling Point: 257.145 °C at 760 mmHg
Flash Point: 101.903 °C
PSA: 20.31000
LogP: 1.00920
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Specification

The 3-Azetidinone,1-(phenylmethyl)-, with the CAS registry number 156303-83-2, has the molecular formula C10H11NO. Besides, this chemical molecular weight is 161.2004. Its systematic name is called 1-benzylazetidin-3-one.

Physical properties of 3-Azetidinone,1-(phenylmethyl)-: (1)ACD/LogP: 0.97; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 2; (6)ACD/KOC (pH 5.5): 46; (7)ACD/KOC (pH 7.4): 47; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.598; (11)Molar Refractivity: 46.699 cm3; (12)Molar Volume: 136.839 cm3; (13)Surface Tension: 51.114 dyne/cm; (14)Density: 1.178 g/cm3; (15)Flash Point: 101.903 °C; (16)Enthalpy of Vaporization: 49.469 kJ/mol; (17)Boiling Point: 257.145 °C at 760 mmHg; (18)Vapour Pressure: 0.015 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2CN(Cc1ccccc1)C2
(2)InChI: InChI=1/C10H11NO/c12-10-7-11(8-10)6-9-4-2-1-3-5-9/h1-5H,6-8H2
(3)InChIKey: BNTLMZDFEGZLOR-UHFFFAOYAL