Cas no 94247-06-0 (2-Propenoic acid,2-methyl-, isotetradecyl ester (9CI))
94247-06-0 structure
Product Name:2-Propenoic acid,2-methyl-, isotetradecyl ester (9CI)
CAS No:94247-06-0
MF:C18H34O2
MW:282.461366176605
CID:810650
PubChem ID:13847819
Update Time:2025-04-19
2-Propenoic acid,2-methyl-, isotetradecyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid,2-methyl-, isotetradecyl ester (9CI)
- 12-methyltridecyl 2-methylprop-2-enoate
- isotetradecyl methacrylate
- QX3EV327JU
- 12-Methyltridecyl methacrylate
- 94247-06-0
- 1814944-46-1
- 2-Propenoic acid, 2-methyl-, 12-methyltridecyl ester
- EINECS 304-182-5
- UNII-QX3EV327JU
- NS00040316
- DTXSID10241245
-
- Inchi： 1S/C18H34O2/c1-16(2)14-12-10-8-6-5-7-9-11-13-15-20-18(19)17(3)4/h16H,3,5-15H2,1-2,4H3
- InChI Key： MRUNBWPNLIPKOT-UHFFFAOYSA-N
- SMILES： O(C(C(=C)C)=O)CCCCCCCCCCCC(C)C
Computed Properties
- Exact Mass: 282.255880323g/mol
- Monoisotopic Mass: 282.255880323g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 14
- Complexity: 256
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: nothing
- Topological Polar Surface Area: 26.3?2
2-Propenoic acid,2-methyl-, isotetradecyl ester (9CI) Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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