Benzoic acid,2-ethenyl- supplier

Name
Benzoic acid, 2-ethenyl- (9CI)
EINECS
CAS No. 27326-43-8
Article Data26
CAS DataBase
Density 1.158 g/cm³
Solubility
Melting Point 94℃
Formula C₉H₈O₂
Boiling Point 282.688 °C at 760 mmHg
Molecular Weight 148.161
Flash Point 129.386 °C
Transport Information
Appearance
Safety 26-39
Risk Codes 37-41
Molecular Structure
Hazard Symbols Xi
Synonyms Benzoicacid, o-vinyl- (7CI,8CI);2-Vinylbenzoic acid;o-Vinylbenzoic acid;
PSA 37.30000
LogP 2.02780

Benzoic acid,2-ethenyl- Specification

The Benzoic acid,2-ethenyl-, with the CAS registry number 27326-43-8, is also known as 2-Vinylbenzoic acid. It belongs to the product categories of Carboxylicacid; Aromatic. This chemical's molecular formula is C₉H₈O₂ and molecular weight is 148.16. What's more, its IUPAC name is 2-ethenylbenzoic acid.

Physical properties of Benzoic acid,2-ethenyl- are: (1)ACD/LogP: 1.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.15; (4)ACD/BCF (pH 5.5): 1; (5)ACD/KOC (pH 5.5): 5.232; (6)#H bond acceptors: 2; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 37.3 Å²; (10)Index of Refraction: 1.606; (11)Molar Refractivity: 44.107 cm³; (12)Molar Volume: 127.911 cm³; (13)Surface Tension: 46.695 dyne/cm; (14)Density: 1.158 g/cm³; (15)Flash Point: 129.386 °C; (16)Enthalpy of Vaporization: 55.089 kJ/mol; (17)Boiling Point: 282.688 °C at 760 mmHg; (18)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C=CC1=CC=CC=C1C(=O)O
(2)InChI: InChI=1S/C9H8O2/c1-2-7-5-3-4-6-8(7)9(10)11/h2-6H,1H2,(H,10,11)
(3)InChIKey: XUDBVJCTLZTSDC-UHFFFAOYSA-N

Product Name

Benzoic acid, 2-ethenyl- (9CI)

Benzoic acid,2-ethenyl- Specification

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