Cas no 10097-26-4 (2-Propenoic acid,2-methyl-, 2-butyloctyl ester)
10097-26-4 structure
Product Name:2-Propenoic acid,2-methyl-, 2-butyloctyl ester
CAS No:10097-26-4
MF:C16H30O2
MW:254.408205509186
CID:181453
PubChem ID:24916
Update Time:2025-04-19
2-Propenoic acid,2-methyl-, 2-butyloctyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid,2-methyl-, 2-butyloctyl ester
- 2-butyloctyl 2-methylprop-2-enoate
- 2-butyloctyl methacrylate
- 2-Butyloktylester kyseliny methakrylove
- 2-Butyloktylester kyseliny methakrylove [Czech]
- Methacrylic acid, 2-butyloctyl ester
- Methacrylic acid 2-butyloctyl ester
- C927XK2YP0
- SCHEMBL17941653
- 2-Propenoic acid, 2-methyl-, 2-butyloctyl ester
- NS00047882
- EINECS 233-231-2
- Q27275333
- 10097-26-4
- DTXSID60905865
- UNII-C927XK2YP0
-
- Inchi: 1S/C16H30O2/c1-5-7-9-10-12-15(11-8-6-2)13-18-16(17)14(3)4/h15H,3,5-13H2,1-2,4H3
- InChI Key: VHGQXSVGGOZFAO-UHFFFAOYSA-N
- SMILES: O(C(C(=C)C)=O)CC(CCCC)CCCCCC
Computed Properties
- Exact Mass: 254.2247
- Monoisotopic Mass: 254.225
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 12
- Complexity: 233
- 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
- Topological Polar Surface Area: 26.3A^2
- XLogP3: 6.4
Experimental Properties
- Density: 0.9887 (rough estimate)
- Boiling Point: 337.63°C (rough estimate)
- Flash Point: 131.3°C
- Refractive Index: 1.4342 (estimate)
- PSA: 26.3
- LogP: 4.88250
2-Propenoic acid,2-methyl-, 2-butyloctyl ester Security Information
- Storage Condition:Warehouse ventilation and low temperature drying
2-Propenoic acid,2-methyl-, 2-butyloctyl ester Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
10097-26-4 (2-Propenoic acid,2-methyl-, 2-butyloctyl ester) Related Products
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