Cas no 84245-81-8 (4-Thiazoleacetic acid, a-(methoxyimino)-2-[(1-oxopropyl)amino]-,methyl ester, (Z)- (9CI))
![4-Thiazoleacetic acid, a-(methoxyimino)-2-[(1-oxopropyl)amino]-,methyl ester, (Z)- (9CI) structure](https://ossimg.kuujia.com/scimg/84500/84245-81-8x500.png)
84245-81-8 structure
Product Name:4-Thiazoleacetic acid, a-(methoxyimino)-2-[(1-oxopropyl)amino]-,methyl ester, (Z)- (9CI)
CAS No:84245-81-8
MF:C10H13N3O4S
MW:271.292920827866
CID:732526
PubChem ID:9588603
Update Time:2025-04-19
4-Thiazoleacetic acid, a-(methoxyimino)-2-[(1-oxopropyl)amino]-,methyl ester, (Z)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 4-Thiazoleacetic acid, a-(methoxyimino)-2-[(1-oxopropyl)amino]-,methyl ester, (Z)- (9CI)
- methyl (2Z)-2-methoxyimino-2-[2-(propanoylamino)-1,3-thiazol-4-yl]acetate
- Methyl (Z)-alpha-(methoxyimino)-2-((1-oxopropyl)amino)-4-thiazoleaceta te
- 84245-81-8
- 4-Thiazoleacetic acid, alpha-(methoxyimino)-2-((1-oxopropyl)amino)-, methyl ester, (Z)-
- Methyl (Z)-alpha-(methoxyimino)-2-((1-oxopropyl)amino)-4-thiazoleacetate
-
- Inchi： 1S/C10H13N3O4S/c1-4-7(14)12-10-11-6(5-18-10)8(13-17-3)9(15)16-2/h5H,4H2,1-3H3,(H,11,12,14)/b13-8-
- InChI Key： PWAIXUOJYRFLMR-JYRVWZFOSA-N
- SMILES： S1C=C(/C(/C(=O)OC)=N/OC)N=C1NC(CC)=O
Computed Properties
- Exact Mass: 271.062677
- Monoisotopic Mass: 271.062677
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 348
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 118
- XLogP3: 1.6
Experimental Properties
- Density: 1.365
- Refractive Index: 1.589
4-Thiazoleacetic acid, a-(methoxyimino)-2-[(1-oxopropyl)amino]-,methyl ester, (Z)- (9CI) Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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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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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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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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