Ethyl 3 acetoxy hexanoate supplier

Name
Ethyl 3 acetoxy hexanoate
EINECS 244-263-1
CAS No. 21188-61-4
Density 1.006 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₈O₄
Boiling Point 200.1 °C at 760 mmHg
Molecular Weight 202.251
Flash Point 82.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Hexanoicacid, 3-hydroxy-, ethyl ester, acetate (6CI,8CI);Ethyl 3-acetoxyhexanoate;
PSA 52.60000
LogP 1.67140

Ethyl 3 acetoxy hexanoate Specification

The Hexanoic acid,3-(acetyloxy)-, ethyl ester, with CAS registry number 21188-61-4, has the systematic name of ethyl 3-(acetyloxy)hexanoate. Besides this, it is also called 3-(acetyloxy)-hexanoicaciethylester. And the chemical formula of this chemical is C₁₀H₁₈O₄.

Physical properties of Hexanoic acid,3-(acetyloxy)-, ethyl ester: (1)ACD/LogP: 2.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.39; (4)ACD/LogD (pH 7.4): 2.39; (5)ACD/BCF (pH 5.5): 38.38; (6)ACD/BCF (pH 7.4): 38.38; (7)ACD/KOC (pH 5.5): 473.7; (8)ACD/KOC (pH 7.4): 473.7; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 52.6 Å²; (13)Index of Refraction: 1.429; (14)Molar Refractivity: 51.88 cm³; (15)Molar Volume: 200.9 cm³; (16)Polarizability: 20.56×10^-24cm³; (17)Surface Tension: 31.7 dyne/cm; (18)Density: 1.006 g/cm³; (19)Flash Point: 82.3 °C; (20)Enthalpy of Vaporization: 43.63 kJ/mol; (21)Boiling Point: 200.1 °C at 760 mmHg; (22)Vapour Pressure: 0.33 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(CC(=O)OCC)CCC)C
(2)InChI: InChI=1/C10H18O4/c1-4-6-9(14-8(3)11)7-10(12)13-5-2/h9H,4-7H2,1-3H3
(3)InChIKey: UYBMIHNGXIOMAW-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C10H18O4/c1-4-6-9(14-8(3)11)7-10(12)13-5-2/h9H,4-7H2,1-3H3
(5)Std. InChIKey: UYBMIHNGXIOMAW-UHFFFAOYSA-N

Product Name

Ethyl 3 acetoxy hexanoate

Ethyl 3 acetoxy hexanoate Specification

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