Cas no 87968-02-3 (1-Propanone,2-chloro-2-methyl-1-(1-piperidinyl)-)
87968-02-3 structure
Product Name:1-Propanone,2-chloro-2-methyl-1-(1-piperidinyl)-
CAS No:87968-02-3
MF:C9H16ClNO
MW:189.682441711426
CID:709092
PubChem ID:13149213
Update Time:2025-04-19
1-Propanone,2-chloro-2-methyl-1-(1-piperidinyl)- Chemical and Physical Properties
Names and Identifiers
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- 1-Propanone,2-chloro-2-methyl-1-(1-piperidinyl)-
- 2-chloro-2-methyl-1-piperidin-1-ylpropan-1-one
- Piperidine, 1-(2-chloro-2-methyl-1-oxopropyl)- (9CI)
- 87968-02-3
- DTXSID70522143
- 2-Chloro-2-methyl-1-(piperidin-1-yl)propan-1-one
- piperidine, 1-(2-chloro-2-methyl-1-oxopropyl)-
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- Inchi： 1S/C9H16ClNO/c1-9(2,10)8(12)11-6-4-3-5-7-11/h3-7H2,1-2H3
- InChI Key： TWHINKKOKOTDLA-UHFFFAOYSA-N
- SMILES： ClC(C)(C)C(N1CCCCC1)=O
Computed Properties
- Exact Mass: 189.0920418g/mol
- Monoisotopic Mass: 189.0920418g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 173
- 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: 1.8
- Topological Polar Surface Area: 20.3?2
1-Propanone,2-chloro-2-methyl-1-(1-piperidinyl)- Related Literature
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1. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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