1H-Pyrazole-1-ethanol,4-bromo- supplier

Name
2-(4-BROMO-1H-PYRAZOL-1-YL)ETHANOL
EINECS
CAS No. 214614-81-0
Article Data6
CAS DataBase
Density 1.743 g/cm³
Solubility
Melting Point
Formula C₅H₇BrN₂O
Boiling Point 299.235 °C at 760 mmHg
Molecular Weight 191.027
Flash Point 134.773 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 2-(4-Bromo-1H-pyrazol-1-yl)ethanol;2-(4-Bromopyrazol-1-yl)ethanol;
PSA 38.05000
LogP 0.63790

1H-Pyrazole-1-ethanol,4-bromo- Specification

The 1H-Pyrazole-1-ethanol,4-bromo-, with the CAS registry number 214614-81-0, is also known as 2-(4-Bromo-1H-pyrazol-1-yl)ethanol. It belongs to the product categories of Building Blocks; Pyrazole. This chemical's molecular formula is C₅H₇BrN₂O and molecular weight is 191.03. What's more, its IUPAC name is 2-(4-bromopyrazol-1-yl)ethanol. When you are using this chemical, please be cautious about it. It may cause inflammation to the skin or other mucous membranes.

Physical properties of 1H-Pyrazole-1-ethanol,4-bromo- are: (1)ACD/LogP: 0.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 35; (8)ACD/KOC (pH 7.4): 35; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 38.05 Å²; (13)Index of Refraction: 1.619; (14)Molar Refractivity: 38.454 cm³; (15)Molar Volume: 109.607 cm³; (16)Polarizability: 15.244×10^-24cm³; (17)Surface Tension: 52.963 dyne/cm; (18)Density: 1.743 g/cm³; (19)Flash Point: 134.773 °C; (20)Enthalpy of Vaporization: 56.941 kJ/mol; (21)Boiling Point: 299.235 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cnn(CCO)c1
(2)Std. InChI: InChI=1S/C5H7BrN2O/c6-5-3-7-8(4-5)1-2-9/h3-4,9H,1-2H2
(3)Std. InChIKey: REUWXYIZJBMWPB-UHFFFAOYSA-N

Product Name

2-(4-BROMO-1H-PYRAZOL-1-YL)ETHANOL

1H-Pyrazole-1-ethanol,4-bromo- Specification

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