Cas no 58105-49-0 (Hexanoic acid,2-ethyl-, 2-propen-1-yl ester)
58105-49-0 structure
Product Name:Hexanoic acid,2-ethyl-, 2-propen-1-yl ester
CAS No:58105-49-0
MF:C11H20O2
MW:184.275303840637
CID:373054
PubChem ID:93958
Update Time:2025-04-19
Hexanoic acid,2-ethyl-, 2-propen-1-yl ester Chemical and Physical Properties
Names and Identifiers
-
- Hexanoic acid,2-ethyl-, 2-propen-1-yl ester
- allyl 2-ethylhexanoate
- prop-2-enyl 2-ethylhexanoate
- AI3-23180
- Hexanoic acid, 2-ethyl-, 21-propenyl ester
- Hexanoic acid, 2-ethyl-, 2-propenyl ester
- prop-2-en-1-yl 2-ethylhexanoate
- DTXSID20973686
- 58105-49-0
- EINECS 261-129-8
- NS00052978
- SCHEMBL1024024
-
- Inchi： 1S/C11H20O2/c1-4-7-8-10(6-3)11(12)13-9-5-2/h5,10H,2,4,6-9H2,1,3H3
- InChI Key： ZEDLAAYLXASWJO-UHFFFAOYSA-N
- SMILES： O(CC=C)C(C(CC)CCCC)=O
Computed Properties
- Exact Mass: 184.1464
- Monoisotopic Mass: 184.146
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 8
- Complexity: 152
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.6
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 0.881
- Boiling Point: 228.8°C at 760 mmHg
- Flash Point: 89.4°C
- Refractive Index: 1.434
- PSA: 26.3
Hexanoic acid,2-ethyl-, 2-propen-1-yl ester Related Literature
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Ying Li,Weirong Yao,Yunfei Xie,Renjun Pei RSC Adv., 2015,5, 98724-98729
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
-
Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
58105-49-0 (Hexanoic acid,2-ethyl-, 2-propen-1-yl ester) Related Products
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- 10032-15-2(Hexyl 2-methylbutanoate)
- 172354-89-1(n-Propyl 2-ethylhexanoate)
- 90397-38-9(2-Methylpentyl 2-methylvalerate)
- 17022-31-0(Valproic Acid Ethyl Ester)
- 125804-07-1(Sodium 2-ethylhexanoate)
- 2835-39-4(Butanoic acid,3-methyl-, 2-propen-1-yl ester)
- 2983-38-2(Etzadroxil)
- 2705-87-5(Allyl 3-cyclohexylpropanoate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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