Cas no 193894-98-3 (Tetradecanoic acid, (3S,6S)-6-(formylamino)hexahydro-1-methyl-7-oxo-1H-azepin-3-yl ester)
193894-98-3 structure
Product Name:Tetradecanoic acid, (3S,6S)-6-(formylamino)hexahydro-1-methyl-7-oxo-1H-azepin-3-yl ester
CAS No:193894-98-3
MF:C22H40N2O4
MW:396.56400680542
CID:2716018
Update Time:2024-03-01
Tetradecanoic acid, (3S,6S)-6-(formylamino)hexahydro-1-methyl-7-oxo-1H-azepin-3-yl ester Chemical and Physical Properties
Names and Identifiers
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- Tetradecanoic acid, (3S,6S)-6-(formylamino)hexahydro-1-methyl-7-oxo-1H-azepin-3-yl ester
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- Inchi： 1S/C22H40N2O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(26)28-19-15-16-20(23-18-25)22(27)24(2)17-19/h18-20H,3-17H2,1-2H3,(H,23,25)/t19-,20-/m0/s1
- InChI Key： WSSBADLNJHGESH-PMACEKPBSA-N
- SMILES： C(O[C@H]1CC[C@H](NC=O)C(=O)N(C)C1)(=O)CCCCCCCCCCCCC
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 28
- XLogP3: 6.406
Tetradecanoic acid, (3S,6S)-6-(formylamino)hexahydro-1-methyl-7-oxo-1H-azepin-3-yl ester Related Literature
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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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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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