decane-2,4,7,9-tetrol

C10H22O4 — CID 87436016

IUPACdecane-2,4,7,9-tetrol
SMILESCC(O)CC(O)CCC(O)CC(C)O
InChIInChI=1S/C10H22O4/c1-7(11)5-9(13)3-4-10(14)6-8(2)12/h7-14H,3-6H2,1-2H3
InChIKeyZZVNVIZYGPROJP-UHFFFAOYSA-N
MW206.28 g/mol
LogP0.03
Rot. Bonds7

About decane-2,4,7,9-tetrol

decane-2,4,7,9-tetrol (PubChem CID 87436016) has the molecular formula C10H22O4 and a molecular weight of 206.28 g/mol. Its IUPAC name is decane-2,4,7,9-tetrol.

Molecular Properties

Compound Namedecane-2,4,7,9-tetrol
PubChem CID87436016
Molecular FormulaC10H22O4
Molecular Weight206.28 g/mol
Exact Mass206.15
IUPAC Namedecane-2,4,7,9-tetrol
SMILESCC(O)CC(O)CCC(O)CC(C)O
InChIInChI=1S/C10H22O4/c1-7(11)5-9(13)3-4-10(14)6-8(2)12/h7-14H,3-6H2,1-2H3
InChIKeyZZVNVIZYGPROJP-UHFFFAOYSA-N
XLogP0.03
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 50.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 161420509
nonane-2,4,6-triol
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nonane-1,4,6,8-tetrol
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(2R,4R)-decane-2,4-diol
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pentadecane-1,12,14-triol
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pentadecane-2,5,8,11,14-pentol
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1-(2,4-dihydroxypentylsulfanyl)pentane-2,4-diol
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tris(pentane-2,4-diol);ruthenium
CID 5231187
europium;tetrakis(pentane-2,4-diol)
CID 59946569
copper bis(pentane-2,4-diol)
CID 135036707
iron(2+);bis(pentane-2,4-diol)
CID 161218003
palladium;bis(pentane-2,4-diol)
CID 58773675

Frequently Asked Questions

What is the IUPAC name of decane-2,4,7,9-tetrol?
The IUPAC name of decane-2,4,7,9-tetrol (CID 87436016) is decane-2,4,7,9-tetrol.
What is the SMILES notation for decane-2,4,7,9-tetrol?
The canonical SMILES for decane-2,4,7,9-tetrol is CC(O)CC(O)CCC(O)CC(C)O.
What is the InChIKey of decane-2,4,7,9-tetrol?
The InChIKey is ZZVNVIZYGPROJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O4/c1-7(11)5-9(13)3-4-10(14)6-8(2)12/h7-14H,3-6H2,1-2H3.
What are the key properties of decane-2,4,7,9-tetrol?
decane-2,4,7,9-tetrol has a molecular weight of 206.28 g/mol, XLogP of 0.03, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for decane-2,4,7,9-tetrol is sourced from PubChem (CID 87436016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).