Phenol,2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]- supplier

Name
2-(5-CHLOROMETHYL-[1,2,4]OXADIAZOL-3-YL)-PHENOL
EINECS
CAS No. 90272-96-1
Density 1.403g/cm³
Solubility
Melting Point
Formula C₉H₇ClN₂O₂
Boiling Point 367.2 °C at 760 mmHg
Molecular Weight 210.62
Flash Point 175.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Phenol,o-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]- (7CI);
PSA
LogP

Phenol,2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]- Specification

The Phenol,2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-, with CAS registry number 90272-96-1, has the systematic name of 2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]phenol. And the chemical formula of this chemical is C₉H₇ClN₂O₂.

Physical properties of Phenol,2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-: (1)ACD/LogP: 2.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.78; (4)ACD/LogD (pH 7.4): 2.5; (5)#H bond acceptors: 4; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 59.15 Å²; (9)Index of Refraction: 1.594; (10)Molar Refractivity: 50.97 cm³; (11)Molar Volume: 150 cm³; (12)Polarizability: 20.2×10^-24cm³; (13)Surface Tension: 57.4 dyne/cm; (14)Enthalpy of Vaporization: 63.78 kJ/mol; (15)Vapour Pressure: 6.58E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccccc1c2nc(CCl)on2
(2)InChI: InChI=1/C9H7ClN2O2/c10-5-8-11-9(12-14-8)6-3-1-2-4-7(6)13/h1-4,13H,5H2
(3)InChIKey: JWQIETXHXBMYPY-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C9H7ClN2O2/c10-5-8-11-9(12-14-8)6-3-1-2-4-7(6)13/h1-4,13H,5H2
(5)Std. InChIKey: JWQIETXHXBMYPY-UHFFFAOYSA-N

Product Name

2-(5-CHLOROMETHYL-[1,2,4]OXADIAZOL-3-YL)-PHENOL

Phenol,2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]- Specification

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