Cas no 104178-93-0 (4-butyl-3,5-dimethylpyridine)
4-butyl-3,5-dimethylpyridine structure
Product Name:4-butyl-3,5-dimethylpyridine
CAS No:104178-93-0
MF:C11H17N
MW:163.259382963181
CID:1147592
PubChem ID:71333149
Update Time:2025-04-20
4-butyl-3,5-dimethylpyridine Chemical and Physical Properties
Names and Identifiers
-
- 4-butyl-3,5-dimethylpyridine
- 104178-93-0
- DTXSID30761455
-
- Inchi： 1S/C11H17N/c1-4-5-6-11-9(2)7-12-8-10(11)3/h7-8H,4-6H2,1-3H3
- InChI Key： DIEXAKYDSYMJGR-UHFFFAOYSA-N
- SMILES： N1C=C(C)C(=C(C=1)C)CCCC
Computed Properties
- Exact Mass: 163.136099547g/mol
- Monoisotopic Mass: 163.136099547g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 112
- 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: 12.9?2
4-butyl-3,5-dimethylpyridine Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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