(1-Phenyl-1H-pyrazol-4-yl)methanol supplier

Name
(1-Phenyl-1H-pyrazol-4-yl)methanol
EINECS
CAS No. 70817-26-4
Article Data10
CAS DataBase
Density 1.16 g/cm³
Solubility
Melting Point 110-111 °C(Solv: water (7732-18-5))
Formula C₁₀H₁₀N₂O
Boiling Point 332.3 °C at 760 mmHg
Molecular Weight 174.202
Flash Point 154.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Pyrazole-4-methanol,1-phenyl- (6CI);(1-Phenyl-1H-pyrazol-4-yl)methanol;
PSA
LogP

(1-Phenyl-1H-pyrazol-4-yl)methanol Specification

The (1-Phenyl-1H-pyrazol-4-yl)methanol, with the cas registry number 70817-26-4, has the IUPAC name of (1-phenylpyrazol-4-yl)methanol. And the molecular formula of the chemical is C₁₀H₁₀N₂O.

The characteristics of this chemical are as followings: (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: 154.8 °C; (14)Enthalpy of Vaporization: 60.7 kJ/mol; (15)Boiling Point: 332.3 °C at 760 mmHg; (16)Vapour Pressure: 5.86E-05 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: n1cc(cn1c2ccccc2)CO
(2)InChI: InChI=1/C10H10N2O/c13-8-9-6-11-12(7-9)10-4-2-1-3-5-10/h1-7,13H,8H2
(3)InChIKey: UCPVQFRIXFGLOJ-UHFFFAOYAD

Product Name

(1-Phenyl-1H-pyrazol-4-yl)methanol

(1-Phenyl-1H-pyrazol-4-yl)methanol Specification

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