Cas no 87118-64-7 (Pentanedioic acid, 3-hydroxy-, monomethyl ester, (S)-)
87118-64-7 structure
Product Name:Pentanedioic acid, 3-hydroxy-, monomethyl ester, (S)-
CAS No:87118-64-7
MF:C6H9O5
MW:161.132662534714
CID:659218
PubChem ID:57354973
Update Time:2025-04-19
Pentanedioic acid, 3-hydroxy-, monomethyl ester, (S)- Chemical and Physical Properties
Names and Identifiers
-
- Pentanedioic acid, 3-hydroxy-, monomethyl ester, (S)-
- (S)-3-Hydroxyglutaricacidmonomethylester
- DTXSID20722813
- 87118-64-7
- (3S)-3-Hydroxy-5-methoxy-5-oxopentanoate
-
- Inchi： 1S/C6H10O5/c1-11-6(10)3-4(7)2-5(8)9/h4,7H,2-3H2,1H3,(H,8,9)/p-1/t4-/m0/s1
- InChI Key： JSEKXOGFRKPXOJ-BYPYZUCNSA-M
- SMILES： O[C@@H](CC(=O)[O-])CC(=O)OC
Computed Properties
- Exact Mass: 161.04499838g/mol
- Monoisotopic Mass: 161.04499838g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 148
- 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
- XLogP3: -0.4
- Topological Polar Surface Area: 86.7?2
Pentanedioic acid, 3-hydroxy-, monomethyl ester, (S)- Related Literature
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
87118-64-7 (Pentanedioic acid, 3-hydroxy-, monomethyl ester, (S)-) Related Products
- 32328-03-3(Diethyl 3-hydroxyglutarate)
- 3976-69-0(Methyl (R)-(-)-3-hydroxybutyrate)
- 7250-55-7(1,5-dimethyl 3-hydroxypentanedioate)
- 21188-58-9(3-Hydroxyhexanoic Acid Methyl Ester)
- 56009-31-5(Methyl 3-Hydroxypentanoate)
- 53562-86-0(Methyl (S)-(+)-3-hydroxybutyrate)
- 2305-25-1(Ethyl 3-hydroxyhexanoate)
- 1487-49-6(Methyl 3-Hydroxybutyrate)
- 42558-50-9(methyl (3S)-3-hydroxypentanoate)
- 51883-36-4(3-Hydroxyhexadecanoic Acid Methyl Ester)
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