Cas no 89109-42-2 (Decanoic acid, 10-amino-9-oxo-, methyl ester, hydrochloride)
89109-42-2 structure
Product Name:Decanoic acid, 10-amino-9-oxo-, methyl ester, hydrochloride
CAS No:89109-42-2
MF:C11H22ClNO3
MW:251.750282764435
CID:612061
PubChem ID:19995253
Update Time:2025-04-19
Decanoic acid, 10-amino-9-oxo-, methyl ester, hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- Decanoic acid, 10-amino-9-oxo-, methyl ester, hydrochloride
- methyl 10-amino-9-oxodecanoate,hydrochloride
- Methyl 10-amino-9-oxodecanoate--hydrogen chloride (1/1)
- SCHEMBL9863432
- DTXSID00601758
- 89109-42-2
-
- Inchi： 1S/C11H21NO3.ClH/c1-15-11(14)8-6-4-2-3-5-7-10(13)9-12;/h2-9,12H2,1H3;1H
- InChI Key： FOEDJXPSQARTFL-UHFFFAOYSA-N
- SMILES： Cl.O(C)C(CCCCCCCC(CN)=O)=O
Computed Properties
- Exact Mass: 251.1288213g/mol
- Monoisotopic Mass: 251.1288213g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 10
- Complexity: 192
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 69.4?2
Decanoic acid, 10-amino-9-oxo-, methyl ester, hydrochloride Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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