Methyl 5-formyl-2-furancarboxylate supplier

Name
METHYL 5-FORMYL-2-FUROATE
EINECS
CAS No. 5904-71-2
Article Data5
CAS DataBase
Density 1.265 g/cm³
Solubility
Melting Point 87-88℃
Formula C₇H₆O₄
Boiling Point 267.894 °C at 760 mmHg
Molecular Weight 154.122
Flash Point 115.819 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Methyl 5-formylfuran-2-carboxylate;Methyl 5-formyl-2-furoate;
PSA 56.51000
LogP 0.87870

Methyl 5-formyl-2-furancarboxylate Specification

The Methyl 5-formyl-2-furancarboxylate, with the CAS registry number 5904-71-2, is also known as Methyl 5-formyl-2-furoate. This chemical's molecular formula is C₇H₆O₄ and molecular weight is 154.12. What's more, its systematic name is methyl 5-formylfuran-2-carboxylate.

Physical properties of Methyl 5-formyl-2-furancarboxylate are: (1)ACD/LogP: 0.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 2; (6)ACD/BCF (pH 7.4): 2; (7)ACD/KOC (pH 5.5): 52; (8)ACD/KOC (pH 7.4): 52; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 56.51 Å²; (13)Index of Refraction: 1.521; (14)Molar Refractivity: 37.079 cm³; (15)Molar Volume: 121.787 cm³; (16)Polarizability: 14.699×10^-24cm³; (17)Surface Tension: 42.613 dyne/cm; (18)Density: 1.265 g/cm³; (19)Flash Point: 115.819 °C; (20)Enthalpy of Vaporization: 50.594 kJ/mol; (21)Boiling Point: 267.894 °C at 760 mmHg; (22)Vapour Pressure: 0.008 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC(=O)C1=CC=C(O1)C=O
(2)InChI: InChI=1S/C7H6O4/c1-10-7(9)6-3-2-5(4-8)11-6/h2-4H,1H3
(3)InChIKey: KDPOOUQFAUOHHX-UHFFFAOYSA-N

Product Name

METHYL 5-FORMYL-2-FUROATE

Methyl 5-formyl-2-furancarboxylate Specification

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