Cas no 94158-95-9 (2-Propenoic acid,2-methyl-, 2-methylundecyl ester)
94158-95-9 structure
Product Name:2-Propenoic acid,2-methyl-, 2-methylundecyl ester
CAS No:94158-95-9
MF:C16H30O2
MW:254.408205509186
CID:807685
PubChem ID:3023823
Update Time:2025-04-19
2-Propenoic acid,2-methyl-, 2-methylundecyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid,2-methyl-, 2-methylundecyl ester
- 2-methylundecyl 2-methylprop-2-enoate
- 2-methylundecyl methacrylate
- NS00066700
- 94158-95-9
- DTXSID70916260
- SCHEMBL15436880
- EINECS 303-169-1
-
- Inchi： 1S/C16H30O2/c1-5-6-7-8-9-10-11-12-15(4)13-18-16(17)14(2)3/h15H,2,5-13H2,1,3-4H3
- InChI Key： CZLJBVBCHWWLFD-UHFFFAOYSA-N
- SMILES： O(C(C(=C)C)=O)CC(C)CCCCCCCCC
Computed Properties
- Exact Mass: 254.225
- 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
- XLogP3: 6.8
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 0.873
- Boiling Point: 318.3°Cat760mmHg
- Flash Point: 131.3°C
- Refractive Index: 1.444
2-Propenoic acid,2-methyl-, 2-methylundecyl ester Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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2. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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