2-Pyrazinecarboxaldehyde,3,5,6-trimethyl- supplier

Name
Pyrazinecarboxaldehyde, trimethyl- (9CI)
EINECS
CAS No. 186534-02-1
Article Data19
CAS DataBase
Density 1.101 g/cm³
Solubility
Melting Point
Formula C₈H₁₀N₂O
Boiling Point 231.756 °C at 760 mmHg
Molecular Weight 150.18
Flash Point 96.785 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Pyrazinecarboxaldehyde,trimethyl- (9CI);3,5,6-trimethylpyrazine-2-carbaldehyde;2-pyrazinecarboxaldehyde, 3,5,6-trimethyl-;
PSA 42.85000
LogP 1.21430

2-Pyrazinecarboxaldehyde,3,5,6-trimethyl- Specification

The 2-Pyrazinecarboxaldehyde,3,5,6-trimethyl-, with the CAS registry number 186534-02-1, has the systematic name of 3,5,6-trimethylpyrazine-2-carbaldehyde. It belongs to the product categories of Aldehyde and Piperidine. And the molecular formula of this chemical is C₈H₁₀N₂O.

The physical properties of 2-Pyrazinecarboxaldehyde,3,5,6-trimethyl- are as following: (1)ACD/LogP: 0.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.499; (4)ACD/LogD (pH 7.4): 0.499; (5)ACD/BCF (pH 5.5): 1.41; (6)ACD/BCF (pH 7.4): 1.41; (7)ACD/KOC (pH 5.5): 44.498; (8)ACD/KOC (pH 7.4): 44.5; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 42.85 Å²; (13)Index of Refraction: 1.553; (14)Molar Refractivity: 43.663 cm³; (15)Molar Volume: 136.372 cm³; (16)Polarizability: 17.309×10^-24cm³; (17)Surface Tension: 45.18 dyne/cm; (18)Density: 1.101 g/cm³; (19)Flash Point: 96.785 °C; (20)Enthalpy of Vaporization: 46.843 kJ/mol; (21)Boiling Point: 231.756 °C at 760 mmHg; (22)Vapour Pressure: 0.061 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1c(nc(c(n1)C)C=O)C
(2)InChI: InChI=1/C8H10N2O/c1-5-6(2)10-8(4-11)7(3)9-5/h4H,1-3H3
(3)InChIKey: HSGOLPGJARMUOX-UHFFFAOYAD

Product Name

Pyrazinecarboxaldehyde, trimethyl- (9CI)

2-Pyrazinecarboxaldehyde,3,5,6-trimethyl- Specification

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