6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol

C6H11FO6 — CID 67723200

IUPAC6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol
SMILESOC(F)C1OC(O)C(O)C(O)C1O
InChIInChI=1S/C6H11FO6/c7-5(11)4-2(9)1(8)3(10)6(12)13-4/h1-6,8-12H
InChIKeyPIZFDKUSPXBELC-UHFFFAOYSA-N
MW198.15 g/mol
LogP-2.93
Rot. Bonds1

About 6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol

6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol (PubChem CID 67723200) has the molecular formula C6H11FO6 and a molecular weight of 198.15 g/mol. Its IUPAC name is 6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol.

Molecular Properties

Compound Name6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol
PubChem CID67723200
Molecular FormulaC6H11FO6
Molecular Weight198.15 g/mol
Exact Mass198.05
IUPAC Name6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol
SMILESOC(F)C1OC(O)C(O)C(O)C1O
InChIInChI=1S/C6H11FO6/c7-5(11)4-2(9)1(8)3(10)6(12)13-4/h1-6,8-12H
InChIKeyPIZFDKUSPXBELC-UHFFFAOYSA-N
XLogP-2.93
TPSA110.38 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.15
LogP ≤ 5-2.93
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

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Related Compounds

(2R,4S,5R)-6-(difluoromethyl)oxane-2,3,4,5-tetrol
CID 71165156
(3R,4S,5R,6S)-6-[amino(hydroxy)methyl]oxane-2,3,4,5-tetrol
CID 67877059
(2R,3S,4S,5R)-5-[(1S)-1-hydroxyethyl]oxolane-2,3,4-triol
CID 22885266
(2R,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]oxane-2,3,4,5-tetrol
CID 132935719
(4R,5S)-6-[(1R)-1,2-dihydroxyethyl]oxane-2,3,4,5-tetrol
CID 172641949
(2R,3S,4S,5S,6R)-6-(1,2-dihydroxyethyl)oxane-2,3,4,5-tetrol
CID 69188119
(2R,3S,4S,5S,6S)-6-[(1R)-1,2-dihydroxyethyl]oxane-2,3,4,5-tetrol
CID 25323127
(2S,3S,4S,5S,6R)-6-[(1R)-1,2-dihydroxyethyl]oxane-2,3,4,5-tetrol
CID 21120523
actinium;(2R,4R,5S)-5-[(1S)-1-hydroxyethyl]oxolane-2,3,4-triol
CID 58666535
[hydroxy-[(2S,3S,4S)-3,4,5-trihydroxyoxolan-2-yl]methyl]-trioxidophosphanium
CID 102233403
hydroxy-[(2S,3R,4S,5R)-3,4,5,6-tetrahydroxyoxan-2-yl]methanesulfonic acid
CID 101411214
(2S,3S,4S,5S,6R)-6-(1,2,3-trihydroxypropyl)oxane-2,3,4,5-tetrol
CID 70476129

Frequently Asked Questions

What is the IUPAC name of 6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol?
The IUPAC name of 6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol (CID 67723200) is 6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol.
What is the SMILES notation for 6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol?
The canonical SMILES for 6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol is OC(F)C1OC(O)C(O)C(O)C1O.
What is the InChIKey of 6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol?
The InChIKey is PIZFDKUSPXBELC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11FO6/c7-5(11)4-2(9)1(8)3(10)6(12)13-4/h1-6,8-12H.
What are the key properties of 6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol?
6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol has a molecular weight of 198.15 g/mol, XLogP of -2.93, 1 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[fluoro(hydroxy)methyl]oxane-2,3,4,5-tetrol is sourced from PubChem (CID 67723200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).