(S)-5-Phenylmorpholin-2-one supplier

Name
(5S)-3,4,5,6-Tetrahydro-5-phenyl-4(H)-1,4-oxazin-2-one
EINECS
CAS No. 144896-92-4
Article Data7
CAS DataBase
Density 1.149 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₁NO₂
Boiling Point 364.33 °C at 760 mmHg
Molecular Weight 177.203
Flash Point 174.141 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Morpholinone,5-phenyl-, (S)-;(5S)-5-Phenylmorpholin-2-one;(5S)-5-Phenylmorpholin-2-on;(5S)-3,4,5,6-Tetrahydro-5-phenyl-4(H)-1,4-oxazin-2-one;(S)-5-Phenyl-morpholin-2-one;
PSA 38.33000
LogP 1.20290

(S)-5-Phenylmorpholin-2-one Specification

The (S)-5-Phenylmorpholin-2-one, with the cas registry number 144896-92-4, is also called (5S)-3,4,5,6-Tetrahydro-5-phenyl-4(H)-1,4-oxazin-2-one. And the molecular formula of the chemical is C₁₀H₁₁NO₂.

The characteristics of this chemical are as followings: (1)ACD/LogP: 0.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 5; (8)ACD/KOC (pH 7.4): 27; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 38.33 Å²; (13)Index of Refraction: 1.535; (14)Molar Refractivity: 47.975 cm³; (15)Molar Volume: 154.212 cm³; (16)Polarizability: 19.019×10^-24cm³; (17)Surface Tension: 39.302 dyne/cm; (18)Density: 1.149 g/cm³; (19)Flash Point: 174.141 °C; (20)Enthalpy of Vaporization: 61.05 kJ/mol; (21)Boiling Point: 364.33 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C1CN[C@H](CO1)c2ccccc2
(2)InChI: InChI=1/C10H11NO2/c12-10-6-11-9(7-13-10)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2/t9-/m1/s1
(3)InChIKey: CMYHFJFAHHKICH-SECBINFHBB

Product Name

(5S)-3,4,5,6-Tetrahydro-5-phenyl-4(H)-1,4-oxazin-2-one

(S)-5-Phenylmorpholin-2-one Specification

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