Cas no 790304-83-5 (2-Oxazolecarboxylic acid, 5-methoxy-, ethyl ester)
790304-83-5 structure
Product Name:2-Oxazolecarboxylic acid, 5-methoxy-, ethyl ester
CAS No:790304-83-5
MF:C7H9NO4
MW:171.150662183762
CID:1794527
PubChem ID:67068411
Update Time:2025-04-21
2-Oxazolecarboxylic acid, 5-methoxy-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Oxazolecarboxylic acid, 5-methoxy-, ethyl ester
- SCHEMBL1536342
- DB-091536
- 790304-83-5
-
- Inchi： 1S/C7H9NO4/c1-3-11-7(9)6-8-4-5(10-2)12-6/h4H,3H2,1-2H3
- InChI Key： KOFUNICPEPAKSH-UHFFFAOYSA-N
- SMILES： O(C(C1=NC=C(OC)O1)=O)CC
Computed Properties
- Exact Mass: 171.05315777g/mol
- Monoisotopic Mass: 171.05315777g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 162
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.2
- Topological Polar Surface Area: 61.6?2
2-Oxazolecarboxylic acid, 5-methoxy-, ethyl ester Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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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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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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