Benzonitrile,2-hydroxy-3-methoxy-5-methyl- supplier

Name
2-hydroxy-3-methoxy-5-methylbenzonitrile
EINECS
CAS No. 6948-31-8
Density 1.2 g/cm³
Solubility
Melting Point
Formula C₉H₉NO₂
Boiling Point 297.2 °C at 760mmHg
Molecular Weight 163.176
Flash Point 133.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,5-Cresotonitrile,3-methoxy- (6CI);NSC 55758;
PSA
LogP

Benzonitrile,2-hydroxy-3-methoxy-5-methyl- Specification

The Benzonitrile,2-hydroxy-3-methoxy-5-methyl- is an organic compound with the molecular formula C₉H₉NO₂. The CAS registry number of this chemical is 6948-31-8. Its IUPAC name is 2-Hydroxy-3-methoxy-5-methylbenzonitrile. What's more, its molecular weight is 163.1733

Physical properties about Benzonitrile,2-hydroxy-3-methoxy-5-methyl- are: (1)ACD/LogP: 1.65; (2)#of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 42.25 Å²; (7)Index of Refraction: 1.558; (8)Molar Refractivity: 43.83 cm³; (9)Molar Volume: 135.7 cm³; (10)Polarizability: 17.37×10^-24 cm³; (11)Surface Tension: 52.3 dyne/cm; (12)Density: 1.2 g/cm³; (13)Flash Point: 133.6 °C; (14)Enthalpy of Vaporization: 55.85 kJ/mol; (15)Boiling Point: 297.2 °C at 760 mmHg; (16)Vapour Pressure: 0.000773 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: N#Cc1cc(cc(OC)c1O)C
(2) InChI: InChI=1/C9H9NO2/c1-6-3-7(5-10)9(11)8(4-6)12-2/h3-4,11H,1-2H3
(3) InChIKey: TXYWKRZGZRSQLC-UHFFFAOYAM

Product Name

2-hydroxy-3-methoxy-5-methylbenzonitrile

Benzonitrile,2-hydroxy-3-methoxy-5-methyl- Specification

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