1,2,3-Thiadiazole-5-methanol,4-methyl- supplier

Name
4-METHYL-1,2,3-THIADIAZOLE-5-METHANOL
EINECS
CAS No. 163008-86-4
Article Data12
CAS DataBase
Density 1.364 g/cm³
Solubility
Melting Point
Formula C₄H₆N₂OS
Boiling Point 261.481 °C at 760 mmHg
Molecular Weight 130.17
Flash Point 111.94 °C
Transport Information
Appearance
Safety
Risk Codes Xi:Irritant;
Molecular Structure
Hazard Symbols Xi
Synonyms 4-METHYL-1,2,3-THIADIAZOLE-5-METHANOL;(4-Methyl-1,2,3-thiadiazol-5-yl)methanol;5-(Hydroxymethyl)-4-methyl-1,2,3-thiadiazole;(4-methyl-1,2,3-thiadiazol-5-yl)methanol(SALTDATA: FREE)
PSA 74.25000
LogP 0.33880

1,2,3-Thiadiazole-5-methanol,4-methyl- Specification

The 1,2,3-Thiadiazole-5-methanol,4-methyl- is an organic compound with the formula C₄H₆N₂OS. The IUPAC name of this chemical is (4-Methylthiadiazol-5-yl)methanol. With the CAS registry number 163008-86-4, it is also named as 4-Methyl-1,2,3-thiadiazole-5-methanol. The product's categories are Hydroxymethyl's; Oxadiazoles and Thiadiazoles. Besides, it should be stored in a cool, sealed, dry, well-ventilated place.

Physical properties about 1,2,3-Thiadiazole-5-methanol,4-methyl- are: (1)ACD/LogP: 0.34; (2)ACD/LogD (pH 5.5): 0.336; (3)ACD/LogD (pH 7.4): 0.336; (4)ACD/BCF (pH 5.5): 1.061; (5)ACD/BCF (pH 7.4): 1.061; (6)ACD/KOC (pH 5.5): 36.299; (7)ACD/KOC (pH 7.4): 36.299; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 74.25 Å²; (12)Index of Refraction: 1.587; (13)Molar Refractivity: 32.096 cm³; (14)Molar Volume: 95.452 cm³; (15)Polarizability: 12.724×10^-24 cm³; (16)Surface Tension: 63.939 dyne/cm; (17)Density: 1.364 g/cm³; (18)Flash Point: 111.94 °C; (19)Enthalpy of Vaporization: 52.742 kJ/mol; (20)Boiling Point: 261.481 °C at 760 mmHg; (21)Vapour Pressure: 0.006 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C4H6N2OS/c1-3-4(2-7)8-6-5-3/h7H,2H2,1H3
(2)InChIKey: MQLRVKHKJCRSBO-UHFFFAOYAW
(3)Std. InChI: InChI=1S/C4H6N2OS/c1-3-4(2-7)8-6-5-3/h7H,2H2,1H3
(4)Std. InChIKey: MQLRVKHKJCRSBO-UHFFFAOYSA-N

Product Name

4-METHYL-1,2,3-THIADIAZOLE-5-METHANOL

1,2,3-Thiadiazole-5-methanol,4-methyl- Specification

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