Cas no 111043-23-3 (Ethyl-(2-hydroxy-3-chlor-propyl)-amin)
111043-23-3 structure
Product Name:Ethyl-(2-hydroxy-3-chlor-propyl)-amin
CAS No:111043-23-3
MF:C5H12ClNO
MW:137.607880592346
CID:2884241
Update Time:2023-08-10
Ethyl-(2-hydroxy-3-chlor-propyl)-amin Chemical and Physical Properties
Names and Identifiers
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- Ethyl-(2-hydroxy-3-chlor-propyl)-amin
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- Inchi： 1S/C5H12ClNO/c1-2-7-4-5(8)3-6/h5,7-8H,2-4H2,1H3
- InChI Key： NLBRJAKOJVBODO-UHFFFAOYSA-N
- SMILES： ClCC(CNCC)O
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 51.7
- XLogP3: 0.1
- Topological Polar Surface Area: 32.299
Ethyl-(2-hydroxy-3-chlor-propyl)-amin Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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