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17682-70-1 | α-L-Sorbofuranose, 2,3:4,6-bis-O-(1-methylethylidene)-
CAS No: 17682-70-1 Catalog No: AG0024XT MDL No:MFCD00132929
Product Description
Catalog Number:
AG0024XT
Chemical Name:
α-L-Sorbofuranose, 2,3:4,6-bis-O-(1-methylethylidene)-
CAS Number:
17682-70-1
Molecular Formula:
C12H20O6
Molecular Weight:
260.2836
MDL Number:
MFCD00132929
IUPAC Name:
[(1R,2S,6S,8S)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecan-6-yl]methanol
InChI:
InChI=1S/C12H20O6/c1-10(2)14-5-7-8(16-10)9-12(6-13,15-7)18-11(3,4)17-9/h7-9,13H,5-6H2,1-4H3/t7-,8+,9-,12-/m0/s1
InChI Key:
GQXSDDHYUVYJCQ-NHRVJRKFSA-N
SMILES:
OC[C@]12O[C@@H]3[C@H]([C@@H]2OC(O1)(C)C)OC(OC3)(C)C
EC Number:
605-783-8
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
260.126g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.286g/mol
Monoisotopic Mass:
260.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
Literature
| Title | Journal |
|---|---|
| 2,3:4,6-Di-O-isopropylidene-alpha-L-sorbofuranose and 2,3-O-isopropylidene-alpha-L-sorbofuranose. | Acta crystallographica. Section C, Crystal structure communications 20090401 |
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