Cas no 824969-82-6 (2-Propenoic acid, 2-methyl-, 1,1-dimethyl-1,4-butanediyl ester)
824969-82-6 structure
Product Name:2-Propenoic acid, 2-methyl-, 1,1-dimethyl-1,4-butanediyl ester
CAS No:824969-82-6
MF:C14H22O4
MW:254.322084903717
CID:689591
PubChem ID:19429011
Update Time:2025-04-19
2-Propenoic acid, 2-methyl-, 1,1-dimethyl-1,4-butanediyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 2-methyl-, 1,1-dimethyl-1,4-butanediyl ester
- [4-methyl-4-(2-methylprop-2-enoyloxy)pentyl] 2-methylprop-2-enoate
- SCHEMBL1162378
- Q27257005
- 824969-82-6
- 3BHT04VYO9
- 4-Methyl-1,4-pentanediyl dimethacrylate
- UNII-3BHT04VYO9
-
- Inchi: 1S/C14H22O4/c1-10(2)12(15)17-9-7-8-14(5,6)18-13(16)11(3)4/h1,3,7-9H2,2,4-6H3
- InChI Key: RNVBRRULAALBHT-UHFFFAOYSA-N
- SMILES: O(C(C(=C)C)=O)C(C)(C)CCCOC(C(=C)C)=O
Computed Properties
- Exact Mass: 254.15180918g/mol
- Monoisotopic Mass: 254.15180918g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 9
- Complexity: 353
- 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
- XLogP3: 3.3
- Topological Polar Surface Area: 52.6?2
2-Propenoic acid, 2-methyl-, 1,1-dimethyl-1,4-butanediyl ester Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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