5-Thiazolemethanol,2,4-dibromo- supplier

Name
2,4-Dibromothiazole-5-methanol
EINECS
CAS No. 170232-68-5
Article Data5
CAS DataBase
Density 2.307g/cm³
Solubility
Melting Point
Formula C₄H₃Br₂NOS
Boiling Point 349.042 °C at 760 mmHg
Molecular Weight 272.948
Flash Point 164.895 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (2,4-Dibromothiazol-5-yl)methanol;2,4-Dibromothiazole-5-methanol;
PSA 61.36000
LogP 2.16040

5-Thiazolemethanol,2,4-dibromo- Specification

The 5-Thiazolemethanol,2,4-dibromo-, with CAS registry number 170232-68-5, has the systematic name of (2,4-dibromo-1,3-thiazol-5-yl)methanol. Besides this, it is also called 2,4-Dibromothiazole-5-methanol. Its molecular weight is 272.9457. And the chemical formula of this chemical is C₄H₃Br₂NOS.

Physical properties of 5-Thiazolemethanol,2,4-dibromo-: (1)ACD/LogP: 1.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 8; (6)ACD/BCF (pH 7.4): 8; (7)ACD/KOC (pH 5.5): 159; (8)ACD/KOC (pH 7.4): 159; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 61.36 Å²; (13)Index of Refraction: 1.677; (14)Molar Refractivity: 44.56 cm³; (15)Molar Volume: 118.323 cm³; (16)Polarizability: 17.665×10^-24cm³; (17)Surface Tension: 67.47 dyne/cm; (18)Density: 2.307 g/cm³; (19)Flash Point: 164.895 °C; (20)Enthalpy of Vaporization: 62.631 kJ/mol; (21)Boiling Point: 349.042 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1nc(Br)sc1CO
(2)InChI: InChI=1/C4H3Br2NOS/c5-3-2(1-8)9-4(6)7-3/h8H,1H2
(3)InChIKey: KDMYXTBGUWUKHT-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C4H3Br2NOS/c5-3-2(1-8)9-4(6)7-3/h8H,1H2
(5)Std. InChIKey: KDMYXTBGUWUKHT-UHFFFAOYSA-N

Product Name

2,4-Dibromothiazole-5-methanol

5-Thiazolemethanol,2,4-dibromo- Specification

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