Cas no 94158-97-1 (2-Propenoic acid,2-methyl-, 2-methyltridecyl ester)
94158-97-1 structure
Product Name:2-Propenoic acid,2-methyl-, 2-methyltridecyl ester
CAS No:94158-97-1
MF:C18H34O2
MW:282.461366176605
CID:808023
PubChem ID:3023825
Update Time:2025-04-19
2-Propenoic acid,2-methyl-, 2-methyltridecyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid,2-methyl-, 2-methyltridecyl ester
- 2-methyltridecyl 2-methylprop-2-enoate
- 2-methyltridecyl methacrylate
- EINECS 303-171-2
- DTXSID00916258
- 94158-97-1
- NS00065476
-
- Inchi： 1S/C18H34O2/c1-5-6-7-8-9-10-11-12-13-14-17(4)15-20-18(19)16(2)3/h17H,2,5-15H2,1,3-4H3
- InChI Key： ZYNRPKSDNPNGAS-UHFFFAOYSA-N
- SMILES： O(C(C(=C)C)=O)CC(C)CCCCCCCCCCC
Computed Properties
- Exact Mass: 282.256
- Monoisotopic Mass: 282.256
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 14
- Complexity: 258
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: nothing
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 0.87
- Boiling Point: 350.8°Cat760mmHg
- Flash Point: 149.4°C
- Refractive Index: 1.447
2-Propenoic acid,2-methyl-, 2-methyltridecyl ester Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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