Pyrazine,2-butyl- supplier | CasNO.29460-91-1

Name
2-BUTYL PYRAZINE
EINECS
CAS No. 29460-91-1
Article Data6
CAS DataBase
Density 0.961 g/cm³
Solubility
Melting Point
Formula C₈H₁₂N₂
Boiling Point 197.9 °C at 760 mmHg
Molecular Weight 136.19
Flash Point 73.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Pyrazine,butyl- (7CI,8CI,9CI);2-Butylpyrazine;Butylpyrazine;
PSA 25.78000
LogP 1.81920

Pyrazine,2-butyl- Specification

The CAS register number of Pyrazine,2-butyl- is 29460-91-1. It also can be called as Butylpyrazine and the systematic name about this chemical is 2-butylpyrazine. The molecular formula about this chemical is C₈H₁₂N₂ and the molecular weight is 136.19. It belongs to the following product category which includes Pyrazines.

Physical properties about Pyrazine,2-butyl- are: (1)ACD/LogP: 1.78; (2)ACD/LogD (pH 5.5): 1.77; (3)ACD/LogD (pH 7.4): 1.77; (4)ACD/BCF (pH 5.5): 13.15; (5)ACD/BCF (pH 7.4): 13.15; (6)ACD/KOC (pH 5.5): 220.01; (7)ACD/KOC (pH 7.4): 220.04; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 25.78 Å²; (11)Index of Refraction: 1.493; (12)Molar Refractivity: 41.25 cm³; (13)Molar Volume: 141.7 cm³; (14)Polarizability: 16.35x10^-24cm³; (15)Surface Tension: 37.9 dyne/cm; (16)Density: 0.961 g/cm³; (17)Flash Point: 73.5 °C; (18)Enthalpy of Vaporization: 41.63 kJ/mol; (19)Boiling Point: 197.9 °C at 760 mmHg; (20)Vapour Pressure: 0.522 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1ccnc(c1)CCCC
(2)InChI: InChI=1/C8H12N2/c1-2-3-4-8-7-9-5-6-10-8/h5-7H,2-4H2,1H3
(3)InChIKey: TVAVRPSANVGCNH-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C8H12N2/c1-2-3-4-8-7-9-5-6-10-8/h5-7H,2-4H2,1H3
(5)Std. InChIKey: TVAVRPSANVGCNH-UHFFFAOYSA-N

Product Name

2-BUTYL PYRAZINE

Pyrazine,2-butyl- Specification

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