Cas no 865366-96-7 (Pentanedioic acid,3-phenyl-, 1-butyl ester, (3S)-)
865366-96-7 structure
Product Name:Pentanedioic acid,3-phenyl-, 1-butyl ester, (3S)-
CAS No:865366-96-7
MF:C15H20O4
MW:264.316905021667
CID:718787
Update Time:2026-04-29
Pentanedioic acid,3-phenyl-, 1-butyl ester, (3S)- Chemical and Physical Properties
Names and Identifiers
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- Pentanedioic acid,3-phenyl-, 1-butyl ester, (3S)-
- Pentanedioic acid, 3-phenyl-, monobutyl ester, (3S)- (9CI)
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Computed Properties
- Exact Mass: 264.136
- Monoisotopic Mass: 264.136
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 9
- Complexity: 282
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 63.6A^2
Pentanedioic acid,3-phenyl-, 1-butyl ester, (3S)- Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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