Cas no 56617-70-0 (Pyrazine, 3,5-dimethyl-2-(2-methylbutyl)- (9CI))
56617-70-0 structure
Product Name:Pyrazine, 3,5-dimethyl-2-(2-methylbutyl)- (9CI)
CAS No:56617-70-0
MF:C11H18N2
MW:178.274022579193
CID:945658
PubChem ID:578813
Update Time:2025-04-19
Pyrazine, 3,5-dimethyl-2-(2-methylbutyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Pyrazine, 3,5-dimethyl-2-(2-methylbutyl)- (9CI)
- 2,6-Dimethyl-3-(2-methylbutyl)pyrazine
- 3,5-dimethyl-2-(2-methylbutyl)pyrazine
- NS00113906
- PYRAZINE, 3,5-DIMETHYL-2-(2-METHYLBUTYL)-
- SCHEMBL9205515
- DTXSID90342123
- 3,5-Dimethyl-2-(2-methylbutyl)pyrazine #
- 2,6-Dimethyl-3(2-methyl-1-butyl)pyrazine
- 2,6-dimethyl-3-(2-methylbutyl)-pyrazine
- QCYKDMGIICAOSJ-UHFFFAOYSA-N
- Pyrazine,3,5-dimethyl-2-(2-methylbutyl)-(9ci)
- DB-327314
- 56617-70-0
-
- Inchi： 1S/C11H18N2/c1-5-8(2)6-11-10(4)13-9(3)7-12-11/h7-8H,5-6H2,1-4H3
- InChI Key： QCYKDMGIICAOSJ-UHFFFAOYSA-N
- SMILES： N1C=C(C)N=C(C)C=1CC(C)CC
Computed Properties
- Exact Mass: 178.14714
- Monoisotopic Mass: 178.146998583g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 147
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 25.8?2
Experimental Properties
- PSA: 25.78
Pyrazine, 3,5-dimethyl-2-(2-methylbutyl)- (9CI) Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
56617-70-0 (Pyrazine, 3,5-dimethyl-2-(2-methylbutyl)- (9CI)) Related Products
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