2-Phenylpyrimidine-5-carboxaldehyde supplier

Name
2-Phenylpyrimidine-5-carboxaldehyde
EINECS
CAS No. 130161-46-5
Article Data9
CAS DataBase
Density 1.205g/cm³
Solubility
Melting Point 132.5-134°C
Formula C₁₁H₈N₂O
Boiling Point 244 °C at 760 mmHg
Molecular Weight 184.197
Flash Point 104.7 °C
Transport Information
Appearance
Safety 26
Risk Codes 22-36
Molecular Structure
Hazard Symbols Xn
Synonyms 2-Phenyl-5-pyrimidinecarboxaldehyde;
PSA 42.85000
LogP 1.95610

2-Phenylpyrimidine-5-carboxaldehyde Specification

The 2-Phenylpyrimidine-5-carboxaldehyde, with CAS registry number 130161-46-5, has the systematic name of 2-phenylpyrimidine-5-carbaldehyde. And its IUPAC name is the same one. Besides this, it is also called 5-pyrimidinecarboxaldehyde, 2-phenyl-. And the chemical formula of this chemical is C₁₁H₈N₂O.

Physical properties of 2-Phenylpyrimidine-5-carboxaldehyde: (1)ACD/LogP: 1.74; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 42.85 Å²; (7)Index of Refraction: 1.621; (8)Molar Refractivity: 53.78 cm³; (9)Molar Volume: 152.8 cm³; (10)Polarizability: 21.32×10^-24cm³; (11)Surface Tension: 53.8 dyne/cm; (12)Enthalpy of Vaporization: 48.11 kJ/mol; (13)Vapour Pressure: 0.0311 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1cnc(nc1)c2ccccc2
(2)InChI: InChI=1/C11H8N2O/c14-8-9-6-12-11(13-7-9)10-4-2-1-3-5-10/h1-8H
(3)InChIKey: AUTGLFSBJLERMV-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C11H8N2O/c14-8-9-6-12-11(13-7-9)10-4-2-1-3-5-10/h1-8H
(5)Std. InChIKey: AUTGLFSBJLERMV-UHFFFAOYSA-N

Product Name

2-Phenylpyrimidine-5-carboxaldehyde

2-Phenylpyrimidine-5-carboxaldehyde Specification

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