4-Isoxazolemethanol,5-methyl-3-phenyl- supplier

Name
(5-METHYL-3-PHENYL-4-ISOXAZOLYL)METHANOL
EINECS
CAS No. 18718-79-1
Article Data10
CAS DataBase
Density 1.176 g/cm³
Solubility
Melting Point 81 °C
Formula C₁₁H₁₁NO₂
Boiling Point 382.4 °C at 760 mmHg
Molecular Weight 189.214
Flash Point 185.1 °C
Transport Information
Appearance White to light yellow crystal powder
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms (5-Methyl-3-phenylisoxazol-4-yl)methanol;
PSA 46.26000
LogP 2.14230

4-Isoxazolemethanol,5-methyl-3-phenyl- Specification

The 4-Isoxazolemethanol,5-methyl-3-phenyl-, with the CAS registry number 18718-79-1, is also known as 4-(Hydroxymethyl)-5-methyl-3-phenylisoxazole. This chemical's molecular formula is C₁₁H₁₁NO₂ and molecular weight is 189.2105. Its systematic name is called (5-methyl-3-phenylisoxazol-4-yl)methanol.

Physical properties of 4-Isoxazolemethanol,5-methyl-3-phenyl-: (1)ACD/LogP: 0.96; (2)ACD/LogD (pH 5.5): 0.96; (3)ACD/LogD (pH 7.4): 0.96; (4)ACD/BCF (pH 5.5): 3.15; (5)ACD/BCF (pH 7.4): 3.15; (6)ACD/KOC (pH 5.5): 79.14; (7)ACD/KOC (pH 7.4): 79.14; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.566; (12)Molar Refractivity: 52.51 cm³; (13)Molar Volume: 160.8 cm³; (14)Surface Tension: 46.4 dyne/cm; (15)Density: 1.176 g/cm³; (16)Flash Point: 185.1 °C; (17)Enthalpy of Vaporization: 66.54 kJ/mol; (18)Boiling Point: 382.4 °C at 760 mmHg; (19)Vapour Pressure: 1.57E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: n1oc(c(c1c2ccccc2)CO)C
(2)InChI: InChI=1/C11H11NO2/c1-8-10(7-13)11(12-14-8)9-5-3-2-4-6-9/h2-6,13H,7H2,1H3
(3)InChIKey: GHGWDZCXZRWQBG-UHFFFAOYAC

Product Name

(5-METHYL-3-PHENYL-4-ISOXAZOLYL)METHANOL

4-Isoxazolemethanol,5-methyl-3-phenyl- Specification

Related Products

Hot Products