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1L-epi-2-Inosose

CAT: 0931-TYD-01128-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-TYD-01128-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
33471-33-9
Bioactivity
1L-epi-2-Inosose is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
Smiles
O[C@H]1[C@@H]([C@H](C([C@H]([C@H]1O)O)=O)O)O
Molecular Formula
C6H10O6
Molecular Weight
178.14
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1L-epi-2-Inosose
CAS Number33471-33-9
PubChem CID9877530
IUPAC Name(2S,3S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexan-1-one
Molecular FormulaC6H10O6
Molecular Weight178.14
XLogP-3.3
Topological Polar Surface Area118
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity174
SMILES
[C@H]1([C@H](C(=O)[C@H]([C@H](C1O)O)O)O)O
InChI
InChI=1S/C6H10O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-5,7-11H/t1?,2-,3-,4-,5+/m0/s1
InChIKey
VYEGBDHSGHXOGT-SHRIJZPSSA-N
Chemical Structure
2D Structure
2D structure of 1L-epi-2-Inosose
CAS: 33471-33-9
CID: 9877530
Formula: C6H10O6
MW: 178.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight178.14
XLogP3-3.3
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass178.04773803
Monoisotopic Mass178.04773803
Topological Polar Surface Area118 Ų
Heavy Atom Count12
Formal Charge0
Complexity174
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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