Cas no 112709-73-6 (Butanoic acid, 2,3-dihydroxy-, methyl ester, (2R,3R)-)
112709-73-6 structure
Product Name:Butanoic acid, 2,3-dihydroxy-, methyl ester, (2R,3R)-
CAS No:112709-73-6
MF:C5H10O4
MW:134.130502223969
CID:1200205
PubChem ID:71355565
Update Time:2025-04-20
Butanoic acid, 2,3-dihydroxy-, methyl ester, (2R,3R)- Chemical and Physical Properties
Names and Identifiers
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- Butanoic acid, 2,3-dihydroxy-, methyl ester, (2R,3R)-
- CS-0530305
- (2R,3R)-Methyl 2,3-dihydroxybutanoate
- Methyl (2R,3R)-2,3-dihydroxybutanoate
- SCHEMBL14932566
- 112709-73-6
-
- Inchi： 1S/C5H10O4/c1-3(6)4(7)5(8)9-2/h3-4,6-7H,1-2H3/t3-,4-/m1/s1
- InChI Key： WSWXGWWRXBEESI-QWWZWVQMSA-N
- SMILES： O[C@H](C)[C@H](C(=O)OC)O
Computed Properties
- Exact Mass: 134.0579
- Monoisotopic Mass: 134.05790880g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 101
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.8
- Topological Polar Surface Area: 66.8?2
Experimental Properties
- PSA: 66.76
Butanoic acid, 2,3-dihydroxy-, methyl ester, (2R,3R)- Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
112709-73-6 (Butanoic acid, 2,3-dihydroxy-, methyl ester, (2R,3R)-) Related Products
- 617-55-0(Dimethyl (S)-(-)-Malate)
- 87-92-3((2R,3R)-Dibutyl 2,3-dihydroxysuccinate)
- 13811-71-7(Diethyl D-(-)-Tartrate)
- 7554-12-3(Diethyl DL-Malate)
- 62961-64-2(D-(-)-Diisopropyl Tartrate)
- 13171-64-7(Dimethyl (2R,3R)-2,3-Dihydroxybutanedioate)
- 2217-15-4((+)-Diisopropyl L-Tartrate)
- 7554-28-1(Diethyl D-Malate)
- 691-84-9(Diethyl L-(-)-Malate)
- 608-68-4((+)-Dimethyl L-Tartrate)
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