Cas no 175346-64-2 (1-[Benzyl(methyl)amino]butan-2-one)
![1-[Benzyl(methyl)amino]butan-2-one structure](https://ossimg.kuujia.com/scimg/175500/175346-64-2x500.png)
175346-64-2 structure
Product Name:1-[Benzyl(methyl)amino]butan-2-one
CAS No:175346-64-2
MF:C12H17NO
MW:191.269483327866
CID:2782520
Update Time:2023-08-07
1-[Benzyl(methyl)amino]butan-2-one Chemical and Physical Properties
Names and Identifiers
-
- 1-[Benzyl(methyl)amino]butan-2-one
- 1-(Methylbenzylamino)-2-butanone
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- Inchi： 1S/C12H17NO/c1-3-12(14)10-13(2)9-11-7-5-4-6-8-11/h4-8H,3,9-10H2,1-2H3
- InChI Key： FJAQSGWDKMBJAP-UHFFFAOYSA-N
- SMILES： O=C(CC)CN(C)CC1C=CC=CC=1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 173
- XLogP3: 2
- Topological Polar Surface Area: 20.3
1-[Benzyl(methyl)amino]butan-2-one Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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