Cas no 15341-70-5 (3-Furancarboxylic acid, 5-(hydroxymethyl)-2-methyl-, ethyl ester)
15341-70-5 structure
Product Name:3-Furancarboxylic acid, 5-(hydroxymethyl)-2-methyl-, ethyl ester
CAS No:15341-70-5
MF:C9H12O4
MW:184.189183235168
CID:1333292
PubChem ID:11830090
Update Time:2025-04-20
3-Furancarboxylic acid, 5-(hydroxymethyl)-2-methyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 3-Furancarboxylic acid, 5-(hydroxymethyl)-2-methyl-, ethyl ester
- ethyl 5-(hydroxymethyl)-2-methylfuran-3-carboxylate
- DTXSID00474045
- 5-methyl-4-carbethoxyfurfuryl alcohol
- 15341-70-5
- SCHEMBL19834811
-
- Inchi： 1S/C9H12O4/c1-3-12-9(11)8-4-7(5-10)13-6(8)2/h4,10H,3,5H2,1-2H3
- InChI Key： SPXOPKHVDHJGLM-UHFFFAOYSA-N
- SMILES： O1C(CO)=CC(C(=O)OCC)=C1C
Computed Properties
- Exact Mass: 184.07355886g/mol
- Monoisotopic Mass: 184.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 181
- 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: 0.8
- Topological Polar Surface Area: 59.7?2
3-Furancarboxylic acid, 5-(hydroxymethyl)-2-methyl-, ethyl ester Related Literature
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
-
Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
15341-70-5 (3-Furancarboxylic acid, 5-(hydroxymethyl)-2-methyl-, ethyl ester) Related Products
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