Methyl 2,3-difluorobenzoate supplier

Name
METHYL 2,3-DIFLUOROBENZOATE
EINECS
CAS No. 18355-74-3
Article Data4
CAS DataBase
Density 1.268 g/cm³
Solubility
Melting Point
Formula C₈H₆F₂O₂
Boiling Point 214.8 °C at 760 mmHg
Molecular Weight 172.131
Flash Point 81.5 °C
Transport Information
Appearance
Safety
Risk Codes F:;
Molecular Structure
Hazard Symbols F
Synonyms Methyl-2,3-difluorbenzolcarboxylat;
PSA 26.30000
LogP 1.75140

Methyl 2,3-difluorobenzoate Specification

The Benzoic acid, 2, 3-difluoro-, methyl ester, with the CAS registry number 18355-74-3, is also known as Methyl-2, 3-difluorbenzolcarboxylat. It belongs to the product category of Aromatic Esters. This chemical's molecular formula is C₈H₆F₂O₂ and molecular weight is 172.13. What's more, its IUPAC name is Methyl 2,3-difluorobenzoate. In addition, this chemical is highly flammable.

Physical properties about Benzoic acid, 2, 3-difluoro-, methyl ester are: (1)ACD/LogP: 2.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.11; (4)ACD/LogD (pH 7.4): 2.11; (5)ACD/BCF (pH 5.5): 23.65; (6)ACD/BCF (pH 7.4): 23.65; (7)ACD/KOC (pH 5.5): 335; (8)ACD/KOC (pH 7.4): 335; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.472; (14)Molar Refractivity: 38.01 cm³; (15)Molar Volume: 135.7 cm³; (16)Polarizability: 15.06×10^-24 cm³; (17)Surface Tension: 33.4 dyne/cm; (18)Density: 1.268 g/cm³; (19)Flash Point: 81.5 °C; (20)Enthalpy of Vaporization: 45.11 kJ/mol; (21)Boiling Point: 214.8 °C at 760 mmHg; (22)Vapour Pressure: 0.153 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1c(C(=O)OC)cccc1F
(2) InChI: InChI=1/C8H6F2O2/c1-12-8(11)5-3-2-4-6(9)7(5)10/h2-4H,1H3
(3) InChIKey: FMTHVBOWAILEFZ-UHFFFAOYAZ

Product Name

METHYL 2,3-DIFLUOROBENZOATE

Methyl 2,3-difluorobenzoate Specification

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