Cas no 15790-87-1 (2-Pentenoic acid, methyl ester, (Z)-)
15790-87-1 structure
Product Name:2-Pentenoic acid, methyl ester, (Z)-
CAS No:15790-87-1
MF:C6H10O2
MW:114.142402172089
CID:1335445
PubChem ID:6197811
Update Time:2025-04-20
2-Pentenoic acid, methyl ester, (Z)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pentenoic acid, methyl ester, (Z)-
- 15790-87-1
- methyl cis-2-pentenoate
- methyl (Z)-pent-2-enoate
- SCHEMBL5834728
- methyl 2-cis-pentenoate
- Methyl pent-2-enoate 97%
- MBAHGFJTIVZLFB-PLNGDYQASA-N
-
- Inchi： 1S/C6H10O2/c1-3-4-5-6(7)8-2/h4-5H,3H2,1-2H3/b5-4-
- InChI Key： MBAHGFJTIVZLFB-PLNGDYQASA-N
- SMILES： O(C)C(/C=C\CC)=O
Computed Properties
- Exact Mass: 114.0681
- Monoisotopic Mass: 114.068079557g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 3
- Complexity: 94.7
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2-Pentenoic acid, methyl ester, (Z)- Related Literature
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
15790-87-1 (2-Pentenoic acid, methyl ester, (Z)-) Related Products
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