Benzenemethanol,3-(1H-pyrazol-1-yl)- supplier

Name
[3-(1H-PYRAZOL-1-YL)PHENYL]METHANOL
EINECS
CAS No. 864068-80-4
Article Data2
CAS DataBase
Density 1.16g/cm³
Solubility
Melting Point
Formula C₁₀H₁₀N₂O
Boiling Point 338.9 °C at 760 mmHg
Molecular Weight 174.2
Flash Point 158.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (3-PYRAZOL-1-YL-PHENYL)-METHANOL;[3-(1H-PYRAZOL-1-YL)PHENYL]METHANOL;[3-(1H-Pyrazol-1-yl)phenyl]methanol 90%;benzenemethanol, 3-(1H-pyrazol-1-yl)-;3-(1H-Pyrazol-1-yl)benzyl alcohol 90%
PSA 38.05000
LogP 1.36460

Benzenemethanol,3-(1H-pyrazol-1-yl)- Specification

The Benzenemethanol,3-(1H-pyrazol-1-yl)-, with CAS registry number 864068-80-4, belongs to the following product categories: (1)Hydroxymethyl's; (2)Phenyls & Phenyl-Het. It has the systematic name of [3-(1H-pyrazol-1-yl)phenyl]methanol. And the chemical formula of this chemical is C₁₀H₁₀N₂O.

Physical properties of Benzenemethanol,3-(1H-pyrazol-1-yl)-: (1)ACD/LogP: 0.93; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 27.05 Å²; (7)Index of Refraction: 1.604; (8)Molar Refractivity: 51.39 cm³; (9)Molar Volume: 149.2 cm³; (10)Polarizability: 20.37×10^-24cm³; (11)Surface Tension: 46.7 dyne/cm; (12)Density: 1.16 g/cm³; (13)Flash Point: 158.7 °C; (14)Enthalpy of Vaporization: 61.46 kJ/mol; (15)Boiling Point: 338.9 °C at 760 mmHg; (16)Vapour Pressure: 3.71E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1cccn1c2cccc(c2)CO
(2)InChI: InChI=1/C10H10N2O/c13-8-9-3-1-4-10(7-9)12-6-2-5-11-12/h1-7,13H,8H2
(3)InChIKey: VINVOQJANISHSK-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C10H10N2O/c13-8-9-3-1-4-10(7-9)12-6-2-5-11-12/h1-7,13H,8H2
(5)Std. InChIKey: VINVOQJANISHSK-UHFFFAOYSA-N

Product Name

[3-(1H-PYRAZOL-1-YL)PHENYL]METHANOL

Benzenemethanol,3-(1H-pyrazol-1-yl)- Specification

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