Cas no 922193-18-8 (Hexadecanoic acid, 2-amino-3-hydroxy-, methyl ester, (2R,3S)-)
922193-18-8 structure
Product Name:Hexadecanoic acid, 2-amino-3-hydroxy-, methyl ester, (2R,3S)-
CAS No:922193-18-8
MF:C17H35NO3
MW:301.464705705643
CID:741228
PubChem ID:71421485
Update Time:2025-04-19
Hexadecanoic acid, 2-amino-3-hydroxy-, methyl ester, (2R,3S)- Chemical and Physical Properties
Names and Identifiers
-
- Hexadecanoic acid, 2-amino-3-hydroxy-, methyl ester, (2R,3S)-
- methyl (2R,3S)-2-amino-3-hydroxyhexadecanoate
- 922193-18-8
- DTXSID60840545
-
- Inchi： 1S/C17H35NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(19)16(18)17(20)21-2/h15-16,19H,3-14,18H2,1-2H3/t15-,16+/m0/s1
- InChI Key： GBGNZAFIITVTRJ-JKSUJKDBSA-N
- SMILES： O[C@H]([C@H](C(=O)OC)N)CCCCCCCCCCCCC
Computed Properties
- Exact Mass: 301.26169398g/mol
- Monoisotopic Mass: 301.26169398g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 15
- Complexity: 246
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.3
- Topological Polar Surface Area: 72.6?2
Hexadecanoic acid, 2-amino-3-hydroxy-, methyl ester, (2R,3S)- Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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