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39668-74-1

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Basic Information
CAS No.: 39668-74-1
Name: Ethyl N-[[5-methyl-2-(isopropyl)cyclohexyl]carbonyl]glycinate
Molecular Structure:
Molecular Structure of 39668-74-1 (Ethyl N-[[5-methyl-2-(isopropyl)cyclohexyl]carbonyl]glycinate)
Formula: C15H27NO3
Molecular Weight: 269.384
Synonyms: WS 5;WS 5(ester);
EINECS: 254-573-9
Density: 0.992 g/cm3
Boiling Point: 390.889 °C at 760 mmHg
Flash Point: 190.203 °C
PSA: 55.40000
LogP: 2.76500
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Specification

The Ethyl N-[[5-methyl-2-(isopropyl)cyclohexyl]carbonyl]glycinate ,its cas register number is 39668-74-1.It also can be called as N-[[5-Methyl-2-(1-methylethyl)cyclohexyl]carbonyl]glycine ethyl ester and the Systematic name about this chemicals is ethyl N-{[5-methyl-2-(propan-2-yl)cyclohexyl]carbonyl}glycinate .

Following are the chemical properties about Ethyl N-[[5-methyl-2-(isopropyl)cyclohexyl]carbonyl]glycinate :(1)#H bond acceptors: 4 ; (2)#H bond donors: 1 ; (3)#Freely Rotating Bonds: 6 ; (4)Polar Surface Area: 55.4Å2 ; (5)Index of Refraction: 1.462 ; (6)Molar Refractivity: 74.717 cm3 ; (7)Molar Volume: 271.624 cm3 ; (8)Polarizability: 29.62x10-24cm3 ; (9)Surface Tension: 33.221 dyne/cm ; (10)Enthalpy of Vaporization: 64.042 kJ/mol ; (11)Vapour Pressure: 0 mmHg at 25°C

This chemicals can be described computed from structure:
(1)SMILES: O=C(OCC)CNC(=O)C1CC(C)CCC1C(C)C
(2)InChI: InChI=1/C15H27NO3/c1-5-19-14(17)9-16-15(18)13-8-11(4)6-7-12(13)10(2)3/h10-13H,5-9H2,1-4H3,(H,16,18)
(3)InChIKey: GWRCTWAPTXBPHW-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C15H27NO3/c1-5-19-14(17)9-16-15(18)13-8-11(4)6-7-12(13)10(2)3/h10-13H,5-9H2,1-4H3,(H,16,18)
(5)Std. InChIKey: GWRCTWAPTXBPHW-UHFFFAOYSA-N