Cas no 6976-96-1 (2-Propenoic acid,2-methyl-, 3-methoxybutyl ester)
6976-96-1 structure
Product Name:2-Propenoic acid,2-methyl-, 3-methoxybutyl ester
2-Propenoic acid,2-methyl-, 3-methoxybutyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid,2-methyl-, 3-methoxybutyl ester
- 3-methoxybutyl 2-methylprop-2-enoate
- 3-METHOXYBUTYL METHACRYLATE
- AC1L5IJP
- AC1Q66KX
- AR-1F4006
- CTK5D1310
- NSC24165
- NSC-24165
- AKOS006345448
- 6976-96-1
- DTXSID80282089
- SCHEMBL554544
-
- Inchi： 1S/C9H16O3/c1-7(2)9(10)12-6-5-8(3)11-4/h8H,1,5-6H2,2-4H3
- InChI Key： NWKKCUWIMOZYOO-UHFFFAOYSA-N
- SMILES： O(C)C(C)CCOC(C(=C)C)=O
Computed Properties
- Exact Mass: 172.10998
- Monoisotopic Mass: 172.11
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 6
- Complexity: 163
- 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: 2.3
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- Density: 0.945
- Boiling Point: 225.4°C at 760 mmHg
- Flash Point: 86.7°C
- Refractive Index: 1.427
- PSA: 35.53
- LogP: 1.53070
2-Propenoic acid,2-methyl-, 3-methoxybutyl ester Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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