3-Pyridinemethanol,5-bromo-2-chloro- supplier

Name
(5-BROMO-2-CHLORO-PYRIDIN-3-YL)-METHANOL
EINECS
CAS No. 742100-75-0
Article Data8
CAS DataBase
Density 1.785 g/cm³
Solubility
Melting Point 76-78 °C
Formula C₆H₅BrClNO
Boiling Point 320.5 °C at 760 mmHg
Molecular Weight 222.467
Flash Point 147.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 5-Bromo-2-chloropyridine-3-methanol;
PSA 33.12000
LogP 1.98980

3-Pyridinemethanol,5-bromo-2-chloro- Specification

The 3-Pyridinemethanol,5-bromo-2-chloro-, with the CAS registry number 742100-75-0, is also known as 5-Bromo-2-chloropyridine-3-methanol. This chemical's molecular formula is C₆H₅BrClNO and molecular weight is 222.467. What's more, its systematic name is called (5-Bromo-2-chloropyridin-3-yl)methanol.

Physical properties about 3-Pyridinemethanol,5-bromo-2-chloro- are: (1)ACD/LogP: 1.18; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.18; (4)ACD/LogD (pH 7.4): 1.18; (5)ACD/BCF (pH 5.5): 4.62; (6)ACD/BCF (pH 7.4): 4.62; (7)ACD/KOC (pH 5.5): 104.06; (8)ACD/KOC (pH 7.4): 104.06; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 33.12 Å²; (13)Index of Refraction: 1.613; (14)Molar Refractivity: 43.38 cm³; (15)Molar Volume: 124.6 cm³; (16)Polarizability: 17.19×10^-24cm³; (17)Surface Tension: 56.2 dyne/cm; (18)Density: 1.785 g/cm³; (19)Flash Point: 147.6 °C; (20)Enthalpy of Vaporization: 59.35 kJ/mol; (21)Boiling Point: 320.5 °C at 760 mmHg; (22)Vapour Pressure: 0.000131 mmHg at 25 °C; (23)Melting Point: 76-78 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OCc1cc(Br)cnc1Cl
(2) InChI: InChI=1/C6H5BrClNO/c7-5-1-4(3-10)6(8)9-2-5/h1-2,10H,3H2
(3) InChIKey: ZZGSPGXWLOYKFH-UHFFFAOYAA

Product Name

(5-BROMO-2-CHLORO-PYRIDIN-3-YL)-METHANOL

3-Pyridinemethanol,5-bromo-2-chloro- Specification

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