Glycine,N-(4-cyclohexyl-1-oxobutyl)- supplier

Name
N-CYCLOHEXANEBUTYRYL GLYCINE
EINECS
CAS No. 132422-42-5
Density 1.079g/cm³
Solubility
Melting Point
Formula C₁₂H₂₁NO₃
Boiling Point 374 °C at 760 mmHg
Molecular Weight 227.304
Flash Point 180 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (4-CYCLOHEXYL-BUTYRYLAMINO)-ACETIC ACID;N-CYCLOHEXANEBUTYRYL GLYCINE;N-CYANOETHYLANILINE;Glycine, N-(4-cyclohexyl-1-oxobutyl)-
PSA 66.40000
LogP 2.32870

Glycine,N-(4-cyclohexyl-1-oxobutyl)- Specification

The Glycine,N-(4-cyclohexyl-1-oxobutyl)-, with CAS registry number 132422-42-5, has the systematic name of 6-cyclohexyl-3-oxonorleucine. Besides this, it is also called N-Cyclohexanebutyryl glycine. And the chemical formula of this chemical is C₁₂H₂₁NO₃.

Physical properties of Glycine,N-(4-cyclohexyl-1-oxobutyl)-: (1)ACD/LogP: 3.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.92; (4)ACD/LogD (pH 7.4): 0.71; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 5.49; (8)ACD/KOC (pH 7.4): 3.41; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 46.61 Å²; (13)Index of Refraction: 1.5; (14)Molar Refractivity: 60.61 cm³; (15)Molar Volume: 205.8 cm³; (16)Polarizability: 24.03×10^-24cm³; (17)Surface Tension: 46.2 dyne/cm; (18)Density: 1.104 g/cm³; (19)Flash Point: 180 °C; (20)Enthalpy of Vaporization: 68.23 kJ/mol; (21)Boiling Point: 374 °C at 760 mmHg; (22)Vapour Pressure: 1.27E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C(N)C(=O)CCCC1CCCCC1
(2)InChI: InChI=1/C12H21NO3/c13-11(12(15)16)10(14)8-4-7-9-5-2-1-3-6-9/h9,11H,1-8,13H2,(H,15,16)
(3)InChIKey: NABIICAILNLMKO-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C12H21NO3/c13-11(12(15)16)10(14)8-4-7-9-5-2-1-3-6-9/h9,11H,1-8,13H2,(H,15,16)
(5)Std. InChIKey: NABIICAILNLMKO-UHFFFAOYSA-N

Product Name

N-CYCLOHEXANEBUTYRYL GLYCINE

Glycine,N-(4-cyclohexyl-1-oxobutyl)- Specification

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