Cas no 61137-13-1 (2-Propenoic acid, 2-(1-methoxy-1-methylethoxy)propyl ester)
61137-13-1 structure
Product Name:2-Propenoic acid, 2-(1-methoxy-1-methylethoxy)propyl ester
CAS No:61137-13-1
MF:C10H18O4
MW:202.247523784637
CID:491006
PubChem ID:71399089
Update Time:2025-04-19
2-Propenoic acid, 2-(1-methoxy-1-methylethoxy)propyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 2-(1-methoxy-1-methylethoxy)propyl ester
- 2-(2-methoxypropan-2-yloxy)propyl prop-2-enoate
- 2-[(2-METHOXYPROPAN-2-YL)OXY]PROPYL PROP-2-ENOATE
- DTXSID70820474
- 61137-13-1
-
- Inchi： 1S/C10H18O4/c1-6-9(11)13-7-8(2)14-10(3,4)12-5/h6,8H,1,7H2,2-5H3
- InChI Key： NWAOMYMQKBLMCB-UHFFFAOYSA-N
- SMILES： O(C(C)COC(C=C)=O)C(C)(C)OC
Computed Properties
- Exact Mass: 202.12054
- Monoisotopic Mass: 202.12050905g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 7
- Complexity: 198
- 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: 1.6
- Topological Polar Surface Area: 44.8?2
Experimental Properties
- PSA: 44.76
2-Propenoic acid, 2-(1-methoxy-1-methylethoxy)propyl ester Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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