CAS No.706789-06-2,(2-CHLOROOXAZOL-4-YL)METHANOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	706789-06-2
Name:	(2-CHLOROOXAZOL-4-YL)METHANOL
Article Data:	4

Formula:	C₄H₄ClNO₂
Molecular Weight:	133.534
Synonyms:	(2-Chloro-1,3-oxazol-4-yl)methanol;(2-chloro-1,3-oxazol-4-yl)methanol;4-oxazolemethanol, 2-chloro-;
Density:	1.463 g/cm³
Boiling Point:	273.2 °C at 760 mmHg
Flash Point:	119 °C
PSA:	46.26000
LogP:	0.82030

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Specification

The 4-Oxazolemethanol,2-chloro-, with the CAS registry number 706789-06-2, has the systematic name of (2-chloro-1,3-oxazol-4-yl)methanol. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₄H₄ClNO₂.

The characteristics of 4-Oxazolemethanol,2-chloro- are as followings: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 23.67; (5)ACD/KOC (pH 7.4): 23.67; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 35.26 Å²; (10)Index of Refraction: 1.525; (11)Molar Refractivity: 27.99 cm³; (12)Molar Volume: 91.2 cm³; (13)Polarizability: 11.09×10^-24cm³; (14)Surface Tension: 51.8 dyne/cm; (15)Density: 1.463 g/cm³; (16)Flash Point: 119 °C; (17)Enthalpy of Vaporization: 54.03 kJ/mol; (18)Boiling Point: 273.2 °C at 760 mmHg; (19)Vapour Pressure: 0.00284 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc1nc(co1)CO
(2)InChI: InChI=1/C4H4ClNO2/c5-4-6-3(1-7)2-8-4/h2,7H,1H2
(3)InChIKey: HMMQMGKNKSNKCV-UHFFFAOYAH