1-Phenyl-1h-pyrazole-5-carbaldehyde supplier

Name
1-Phenyl-1h-pyrazole-5-carbaldehyde
EINECS
CAS No. 132274-70-5
Article Data6
CAS DataBase
Density 1.15g/cm³
Solubility
Melting Point 31 °C
Formula C₁₀H₈N₂O
Boiling Point 312.7 °C at 760 mmHg
Molecular Weight 172.186
Flash Point 142.9 °C
Transport Information
Appearance
Safety 24/25
Risk Codes 22
Molecular Structure
Hazard Symbols Xn
Synonyms 1-PHENYL-1H-PYRAZOLE-5-CARBALDEHYDE;1-PHENYL-1H-PYRAZOLE-5-CARBOXALDEHYDE;1-phenyl-1H-pyrazole-5-carbaldehyde(SALTDATA: FREE);1-phenyl-1H-pyrazol-5-carbaldehyde;1H-Pyrazole-5-carboxaldehyde, 1-phenyl-
PSA 34.89000
LogP 1.68480

1-Phenyl-1h-pyrazole-5-carbaldehyde Specification

The 1-Phenyl-1h-pyrazole-5-carbaldehyde, with CAS registry number 132274-70-5, has the systematic name of 1-phenyl-1H-pyrazole-5-carbaldehyde. Besides this, it is also called 1H-pyrazole-5-carboxaldehyde, 1-phenyl-. When use this chemical, avoid contact with skin and eyes. And the chemical formula of this chemical is C₁₀H₈N₂O.

Physical properties of 1-Phenyl-1h-pyrazole-5-carbaldehyde: (1)ACD/LogP: 1.54; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.54; (4)ACD/LogD (pH 7.4): 1.54; (5)ACD/BCF (pH 5.5): 8.68; (6)ACD/BCF (pH 7.4): 8.68; (7)ACD/KOC (pH 5.5): 163.4; (8)ACD/KOC (pH 7.4): 163.4; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 34.89 Å²; (13)Index of Refraction: 1.604; (14)Molar Refractivity: 51.39 cm³; (15)Molar Volume: 149.2 cm³; (16)Polarizability: 20.37×10^-24cm³; (17)Surface Tension: 46.7 dyne/cm; (18)Density: 1.15 g/cm³; (19)Flash Point: 142.9 °C; (20)Enthalpy of Vaporization: 55.37 kJ/mol; (21)Boiling Point: 312.7 °C at 760 mmHg; (22)Vapour Pressure: 0.00052 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc2ccnn2c1ccccc1
(2)InChI: InChI=1/C10H8N2O/c13-8-10-6-7-11-12(10)9-4-2-1-3-5-9/h1-8H
(3)InChIKey: OQORFMABOZEDBL-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C10H8N2O/c13-8-10-6-7-11-12(10)9-4-2-1-3-5-9/h1-8H
(5)Std. InChIKey: OQORFMABOZEDBL-UHFFFAOYSA-N

Product Name

1-Phenyl-1h-pyrazole-5-carbaldehyde

1-Phenyl-1h-pyrazole-5-carbaldehyde Specification

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