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CAS No.: | 23780-13-4 |
---|---|
Name: | (2-PHENYL-1,3-THIAZOL-4-YL)METHANOL |
Article Data: | 17 |
Molecular Structure: | |
Formula: | C10H9NOS |
Molecular Weight: | 191.254 |
Synonyms: | (2-Phenyl-1,3-thiazol-4-yl)methanol;2-Phenyl-4-thiazolylmethanol; |
Density: | 1.264 g/cm3 |
Melting Point: | 65 °C |
Boiling Point: | 372.2 °C at 760 mmHg |
Flash Point: | 178.9 °C |
Hazard Symbols: | Xi |
Risk Codes: | 24/25 |
Safety: | 22-36/37/39 |
PSA: | 61.36000 |
LogP: | 2.30240 |
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The 4-Thiazolemethanol,2-phenyl- is an organic compound with the formula C10H9NOS. The systematic name of this chemical is (2-phenyl-1,3-thiazol-4-yl)methanol. With the CAS registry number 23780-13-4, it is also named as 4-(Hydroxymethyl)-2-phenyl-1,3-thiazole.
Physical properties about 4-Thiazolemethanol,2-phenyl- are: (1)ACD/LogP: 2.06; (2)ACD/LogD (pH 5.5): 2.06; (3)ACD/LogD (pH 7.4): 2.06; (4)ACD/BCF (pH 5.5): 21.49; (5)ACD/BCF (pH 7.4): 21.49; (6)ACD/KOC (pH 5.5): 312.75; (7)ACD/KOC (pH 7.4): 312.82; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 50.36 Å2; (12)Index of Refraction: 1.629; (13)Molar Refractivity: 53.77 cm3; (14)Molar Volume: 151.2 cm3; (15)Polarizability: 21.31×10-24cm3; (16)Surface Tension: 54.7 dyne/cm; (17)Density: 1.264 g/cm3; (18)Flash Point: 178.9 °C; (19)Enthalpy of Vaporization: 65.34 kJ/mol; (20)Boiling Point: 372.2 °C at 760 mmHg; (21)Vapour Pressure: 3.37E-06 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is toxic in contact with skin and if swallowed. When you are using it, wear suitable gloves and eye/face protection and do not breathe dust.
You can still convert the following datas into molecular structure:
(1)SMILES: n1c(csc1c2ccccc2)CO
(2)InChI: InChI=1/C10H9NOS/c12-6-9-7-13-10(11-9)8-4-2-1-3-5-8/h1-5,7,12H,6H2
(3)InChIKey: HNFDKPSDOQRBBX-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C10H9NOS/c12-6-9-7-13-10(11-9)8-4-2-1-3-5-8/h1-5,7,12H,6H2
(5)Std. InChIKey: HNFDKPSDOQRBBX-UHFFFAOYSA-N