Cas no 71888-53-4 (Butanedioic acid,2,3-dihydroxy- (2R,3R)-, bis(1-methylpropyl) ester (9CI))
71888-53-4 structure
Product Name:Butanedioic acid,2,3-dihydroxy- (2R,3R)-, bis(1-methylpropyl) ester (9CI)
CAS No:71888-53-4
MF:C12H22O6
MW:262.299484729767
CID:573787
PubChem ID:12075106
Update Time:2025-04-19
Butanedioic acid,2,3-dihydroxy- (2R,3R)-, bis(1-methylpropyl) ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Butanedioic acid,2,3-dihydroxy- (2R,3R)-, bis(1-methylpropyl) ester (9CI)
- Di-sec-butyl tartrate
- dibutan-2-yl 2,3-dihydroxybutanedioate
- 71888-53-4
- DTXSID70992589
- EINECS 276-141-9
-
- Inchi： 1S/C12H22O6/c1-5-7(3)17-11(15)9(13)10(14)12(16)18-8(4)6-2/h7-10,13-14H,5-6H2,1-4H3
- InChI Key： JLGAZDKLNOHWJJ-UHFFFAOYSA-N
- SMILES： O(C(C(C(C(=O)OC(C)CC)O)O)=O)C(C)CC
Computed Properties
- Exact Mass: 262.14166
- Monoisotopic Mass: 262.14163842g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 9
- Complexity: 250
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 93.1?2
Experimental Properties
- PSA: 93.06
Butanedioic acid,2,3-dihydroxy- (2R,3R)-, bis(1-methylpropyl) ester (9CI) Related Literature
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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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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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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
71888-53-4 (Butanedioic acid,2,3-dihydroxy- (2R,3R)-, bis(1-methylpropyl) ester (9CI)) Related Products
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- 691-84-9(Diethyl L-(-)-Malate)
- 608-68-4((+)-Dimethyl L-Tartrate)
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