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114861-22-2 | α-L-Xylofuranose, 1,2-O-(1-methylethylidene)-
CAS No: 114861-22-2 Catalog No: AG000FDC MDL No:MFCD00010529
Product Description
Catalog Number:
AG000FDC
Chemical Name:
α-L-Xylofuranose, 1,2-O-(1-methylethylidene)-
CAS Number:
114861-22-2
Molecular Formula:
C8H14O5
Molecular Weight:
190.1938
MDL Number:
MFCD00010529
IUPAC Name:
(3aS,5S,6R,6aS)-5-(hydroxymethyl)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol
InChI:
InChI=1S/C8H14O5/c1-8(2)12-6-5(10)4(3-9)11-7(6)13-8/h4-7,9-10H,3H2,1-2H3/t4-,5+,6-,7-/m0/s1
InChI Key:
JAUQZVBVVJJRKM-VZFHVOOUSA-N
SMILES:
OC[C@@H]1O[C@@H]2[C@H]([C@@H]1O)OC(O2)(C)C
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
190.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
190.195g/mol
Monoisotopic Mass:
190.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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