3-Furancarboxylic acid,tetrahydro-5-oxo-2-phenyl- supplier

Name
TETRAHYDRO-5-OXO-2-PHENYLFURAN-3-CARBOXYLIC ACID
EINECS
CAS No. 13389-88-3
Article Data15
CAS DataBase
Density 1.35 g/cm³
Solubility
Melting Point 95-97 °C
Formula C₁₁H₁₀O₄
Boiling Point 467.5 °C at 760 mmHg
Molecular Weight 206.198
Flash Point 191.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Furoicacid, tetrahydro-5-oxo-2-phenyl- (8CI);Succinic acid, (a-hydroxybenzyl)-, g-lactone (6CI);Tetrahydro-5-oxo-2-phenyl-3-furancarboxylicacid;
PSA 63.60000
LogP 1.37540

3-Furancarboxylic acid,tetrahydro-5-oxo-2-phenyl- Specification

The 3-Furancarboxylic acid, tetrahydro-5-oxo-2-phenyl-, with the CAS registry number 13389-88-3, is also known as Tetrahydro-5-oxo-2-phenyl-3-furancarboxylicacid. This chemical's molecular formula is C₁₁H₁₀O₄ and molecular weight is 206.19. What's more, its systematic name is 5-Oxo-2-phenyltetrahydrofuran-3-carboxylic acid.

Physical properties about 3-Furancarboxylic acid, tetrahydro-5-oxo-2-phenyl- are: (1)ACD/LogP: 0.53; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 52.6 Å²; (11)Index of Refraction: 1.578; (12)Molar Refractivity: 50.73 cm³; (13)Molar Volume: 152.6 cm³; (14)Polarizability: 20.11×10^-24 cm³; (15)Surface Tension: 56.2 dyne/cm; (16)Density: 1.35 g/cm³; (17)Flash Point: 191.5 °C; (18)Enthalpy of Vaporization: 76.86 kJ/mol; (19)Boiling Point: 467.5 °C at 760 mmHg; (20)Vapour Pressure: 1.53E-09 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C2OC(c1ccccc1)C(C(=O)O)C2
(2) InChI: InChI=1/C11H10O4/c12-9-6-8(11(13)14)10(15-9)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,13,14)
(3) InChIKey: LRMTVZBRYDTDCU-UHFFFAOYAZ

Product Name

TETRAHYDRO-5-OXO-2-PHENYLFURAN-3-CARBOXYLIC ACID

3-Furancarboxylic acid,tetrahydro-5-oxo-2-phenyl- Specification

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