Ethyl tetrahydro-3-furoate supplier

Name
Ethyl tetrahydro-3-furoate
EINECS
CAS No. 139172-64-8
Article Data1
CAS DataBase
Density 1.076 g/cm³
Solubility
Melting Point
Formula C₇H₁₂O₃
Boiling Point 180.8 °C at 760 mmHg
Molecular Weight 144.16838
Flash Point 65.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Furancarboxylic acid, tetrahydro-, ethyl ester;
PSA 35.53000
LogP 0.58600

Ethyl tetrahydro-3-furoate Specification

The Ethyl tetrahydro-3-furoate, with the CAS registry number 139172-64-8, is also known as 3-Furancarboxylic acid, tetrahydro-, ethyl ester. It belongs to the product category of Carboxylicester. This chemical's molecular formula is C₇H₁₂O₃ and molecular weight is 144.16838. What's more, its systematic name is Ethyl tetrahydrofuran-3-carboxylate.

Physical properties about Ethyl tetrahydro-3-furoate are: (1)ACD/LogP: 0.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.48; (4)ACD/LogD (pH 7.4): 0.48; (5)ACD/BCF (pH 5.5): 1.37; (6)ACD/BCF (pH 7.4): 1.37; (7)ACD/KOC (pH 5.5): 43.55; (8)ACD/KOC (pH 7.4): 43.55; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.445; (14)Molar Refractivity: 35.63 cm³; (15)Molar Volume: 133.8 cm³; (16)Polarizability: 14.12×10^-24 cm³; (17)Surface Tension: 34.5 dyne/cm; (18)Density: 1.076 g/cm³; (19)Flash Point: 65.6 °C; (20)Enthalpy of Vaporization: 41.71 kJ/mol; (21)Boiling Point: 180.8 °C at 760 mmHg; (22)Vapour Pressure: 0.879 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC)C1COCC1
(2) InChI: InChI=1/C7H12O3/c1-2-10-7(8)6-3-4-9-5-6/h6H,2-5H2,1H3
(3) InChIKey: XEQXCAOMSYMYRD-UHFFFAOYAB

Product Name

Ethyl tetrahydro-3-furoate

Ethyl tetrahydro-3-furoate Specification

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