Chemical Properties of Pyrazine, 2,5-diethyl- (CAS 13238-84-1)

InChI

InChI=1S/C8H12N2/c1-3-7-5-10-8(4-2)6-9-7/h5-6H,3-4H2,1-2H3

InChI Key

WAVOLMBVDCRBGR-UHFFFAOYSA-N

Formula

C8H12N2

SMILES

CCc1cnc(CC)cn1

Molecular Weight¹

136.19

CAS

13238-84-1

Other Names

• 2,5-Diethylpyrazine

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-2.61		Crippen Calculated Property
logPoct/wat	1.601		Crippen Calculated Property
McVol	119.780	ml/mol	McGowan Calculated Property
Inp	[1048.00; 1095.00]
Inp	1091.00		NIST
Inp	1089.00		NIST
Inp	1074.00		NIST
Inp	1064.00		NIST
Inp	1090.00		NIST
Inp	1094.00		NIST
Inp	1095.00		NIST
Inp	1087.00		NIST
Inp	1062.00		NIST
Inp	1063.00		NIST
Inp	Outlier 1048.00		NIST
Inp	1085.00		NIST
Inp	1091.00		NIST
Inp	1091.00		NIST
Inp	1077.00		NIST
Inp	1091.00		NIST
I	[1425.00; 1492.00]
I	1461.00		NIST
I	1460.00		NIST
I	1463.00		NIST
I	1425.00		NIST
I	1445.00		NIST
I	1443.00		NIST
I	Outlier 1492.00		NIST
I	1449.00		NIST
I	1456.00		NIST
I	1433.00		NIST
I	1463.00		NIST

Similar Compounds

Find more compounds similar to Pyrazine, 2,5-diethyl-.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.