Cas no 62597-13-1 (Spiro[2.4]heptane-1-carboxylic acid, 2-(2-methyl-1-propenyl)-, ethylester)
62597-13-1 structure
Product Name:Spiro[2.4]heptane-1-carboxylic acid, 2-(2-methyl-1-propenyl)-, ethylester
CAS No:62597-13-1
MF:C14H22O2
MW:222.323284626007
CID:438662
Update Time:2025-04-19
Spiro[2.4]heptane-1-carboxylic acid, 2-(2-methyl-1-propenyl)-, ethylester Chemical and Physical Properties
Names and Identifiers
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- Spiro[2.4]heptane-1-carboxylic acid, 2-(2-methyl-1-propenyl)-, ethylester
- Spiro[2.4]heptane-1-carboxylic acid, 2-(2-methyl-1-propen-1-yl)-, ethyl ester
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- Inchi: 1S/C14H22O2/c1-4-16-13(15)12-11(9-10(2)3)14(12)7-5-6-8-14/h9,11-12H,4-8H2,1-3H3
- InChI Key: FNBNANOORNACHL-UHFFFAOYSA-N
- SMILES: C1(C(OCC)=O)C2(CCCC2)C1/C=C(/C)\C
Computed Properties
- Exact Mass: 222.16206
Experimental Properties
- PSA: 26.3
Spiro[2.4]heptane-1-carboxylic acid, 2-(2-methyl-1-propenyl)-, ethylester Related Literature
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Kevin M. Koo,Abu Ali Ibn Sina,Laura G. Carrascosa,Muhammad J. A. Shiddiky Analyst, 2014,139, 6178-6184
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Riccardo Spezia,Stefan Knecht,Benedetta Mennucci Phys. Chem. Chem. Phys., 2017,19, 17156-17166
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Sheng Wang,Wenxian Xie,Xiu Zhang,Xia Zou,Yan Zhang Chem. Commun., 2012,48, 5907-5909
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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