Cas no 50623-73-9 (1,2,3,4-Butanetetrol,1,4-bis(4-methylbenzenesulfonate), (2R,3R)-)
50623-73-9 structure
Product Name:1,2,3,4-Butanetetrol,1,4-bis(4-methylbenzenesulfonate), (2R,3R)-
CAS No:50623-73-9
MF:C18H22O8S2
MW:430.492483615875
CID:381606
PubChem ID:275952
Update Time:2025-04-19
1,2,3,4-Butanetetrol,1,4-bis(4-methylbenzenesulfonate), (2R,3R)- Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3,4-Butanetetrol,1,4-bis(4-methylbenzenesulfonate), (2R,3R)-
- (+)-1 4-DI-O-TOSYL-D-THREITOL
- [(2R,3R)-2,3-dihydroxy-4-(4-methylphenyl)sulfonyloxybutyl] 4-methylbenzenesulfonate
- L-THREITOL 1,4-DI-P-TOSYLATE
- NSC-297839
- NSC-123094
- DTXSID50964860
- NSC297839
- NSC-260675
- NSC123094
- 68138-99-8
- SCHEMBL1730532
- NSC260675
- 50623-73-9
- NSC126574
- FT-0639916
- [2,3-dihydroxy-4-(4-methylphenyl)sulfonyloxybutyl] 4-methylbenzenesulfonate
- NSC-126574
- 2,3-Dihydroxybutane-1,4-diyl bis(4-methylbenzene-1-sulfonate)
-
- Inchi： 1S/C18H22O8S2/c1-13-3-7-15(8-4-13)27(21,22)25-11-17(19)18(20)12-26-28(23,24)16-9-5-14(2)6-10-16/h3-10,17-20H,11-12H2,1-2H3
- InChI Key： FOQGPMGPNUYCOK-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C)=CC=1)(=O)(=O)OCC(C(COS(C1C=CC(C)=CC=1)(=O)=O)O)O
Computed Properties
- Exact Mass: 430.07566
- Monoisotopic Mass: 430.076
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 28
- Rotatable Bond Count: 9
- Complexity: 603
- 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
- Topological Polar Surface Area: 144A^2
- XLogP3: 1.7
Experimental Properties
- Density: 1.397
- Boiling Point: 657.6°Cat760mmHg
- Flash Point: 351.5°C
- Refractive Index: 1.586
- PSA: 127.2
- LogP: 3.29760
1,2,3,4-Butanetetrol,1,4-bis(4-methylbenzenesulfonate), (2R,3R)- Related Literature
-
Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
-
Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
50623-73-9 (1,2,3,4-Butanetetrol,1,4-bis(4-methylbenzenesulfonate), (2R,3R)-) Related Products
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