Cas no 2492-34-4 (Butyl, 1-methyl-(6CI,7CI,8CI,9CI))
2492-34-4 structure
Product Name:Butyl, 1-methyl-(6CI,7CI,8CI,9CI)
Butyl, 1-methyl-(6CI,7CI,8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Butyl, 1-methyl-(6CI,7CI,8CI,9CI)
- pentane
- 2492-34-4
- DTXSID40179628
- 2-Pentyl radical
- CH3CH2CH2CHCH3
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- Inchi: 1S/C5H11/c1-3-5-4-2/h3H,4-5H2,1-2H3
- InChI Key: HAMMRVGIRNLATI-UHFFFAOYSA-N
- SMILES: C([CH]C)CC |^1:1|
Computed Properties
- Exact Mass: 72.09396
- Monoisotopic Mass: 71.086075351g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 5
- Rotatable Bond Count: 2
- Complexity: 9.5
- 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: 3.4
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Butyl, 1-methyl-(6CI,7CI,8CI,9CI) Related Literature
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Yunfei Yao,Bo Lin,Minze Wu,Yafang Zhang,Yangjie Huang,Xiaoyan Han,Zhiqiang Weng Org. Biomol. Chem. 2022 20 8761
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Tabrez R. Shaikh,Christy P. George,Priyanka Bhukya,Nikita Shelke,Komal Pawar,Abhijit Garai,Rambabu Dandela,Rajesh G. Gonnade,Ashwini K. Nangia CrystEngComm 2022 24 7387
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Zhong Zhou,Huihui Ji,Qing Li,Qian Zhang,Dong Li Org. Biomol. Chem. 2021 19 2917
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Tingting Cao,Jiushi Liu,Xiaoyi Zhang,Xueping Wei,Yaodong Qi,Bengang Zhang,Haitao Liu,Peigen Xiao Anal. Methods 2019 11 2700
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