Cas no 88346-46-7 (Pyrazine, 2,5-dibutyl-3-chloro-)
88346-46-7 structure
Product Name:Pyrazine, 2,5-dibutyl-3-chloro-
CAS No:88346-46-7
MF:C12H19ClN2
MW:226.745661973953
CID:636220
PubChem ID:13143715
Update Time:2025-04-19
Pyrazine, 2,5-dibutyl-3-chloro- Chemical and Physical Properties
Names and Identifiers
-
- Pyrazine, 2,5-dibutyl-3-chloro-
- 2,5-dibutyl-3-chloropyrazine
- DTXSID30521516
- 88346-46-7
-
- Inchi： 1S/C12H19ClN2/c1-3-5-7-10-9-14-11(8-6-4-2)12(13)15-10/h9H,3-8H2,1-2H3
- InChI Key： JAHOTFJUWBOJLS-UHFFFAOYSA-N
- SMILES： ClC1C(CCCC)=NC=C(CCCC)N=1
Computed Properties
- Exact Mass: 226.1236763g/mol
- Monoisotopic Mass: 226.1236763g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 164
- 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: 4.2
- Topological Polar Surface Area: 25.8?2
Pyrazine, 2,5-dibutyl-3-chloro- Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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