Cas no 124420-65-1 (Pyrazine,2,5-dichloro-3-(2-chloro-1,1-dimethylethyl)-)
124420-65-1 structure
Product Name:Pyrazine,2,5-dichloro-3-(2-chloro-1,1-dimethylethyl)-
CAS No:124420-65-1
MF:C8H9Cl3N2
MW:239.529458761215
CID:158804
PubChem ID:183724
Update Time:2025-04-19
Pyrazine,2,5-dichloro-3-(2-chloro-1,1-dimethylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Pyrazine,2,5-dichloro-3-(2-chloro-1,1-dimethylethyl)-
- 2,5-dichloro-3-(1-chloro-2-methylpropan-2-yl)pyrazine
- DTXSID30154363
- 124420-65-1
-
- Inchi： 1S/C8H9Cl3N2/c1-8(2,4-9)6-7(11)12-3-5(10)13-6/h3H,4H2,1-2H3
- InChI Key： JHLQRYOSLRFTMO-UHFFFAOYSA-N
- SMILES： ClCC(C)(C)C1C(=NC=C(N=1)Cl)Cl
Computed Properties
- Exact Mass: 237.98337
- Monoisotopic Mass: 237.983131g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 175
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 25.8?2
Experimental Properties
- PSA: 25.78
Pyrazine,2,5-dichloro-3-(2-chloro-1,1-dimethylethyl)- Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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