octadecane-5,9,10,14-tetrol

C18H38O4 — CID 123917796

IUPACoctadecane-5,9,10,14-tetrol
SMILESCCCCC(O)CCCC(O)C(O)CCCC(O)CCCC
InChIInChI=1S/C18H38O4/c1-3-5-9-15(19)11-7-13-17(21)18(22)14-8-12-16(20)10-6-4-2/h15-22H,3-14H2,1-2H3
InChIKeyGWOCZADCGKDYPZ-UHFFFAOYSA-N
MW318.50 g/mol
LogP3.15
Rot. Bonds15

About octadecane-5,9,10,14-tetrol

octadecane-5,9,10,14-tetrol (PubChem CID 123917796) has the molecular formula C18H38O4 and a molecular weight of 318.50 g/mol. Its IUPAC name is octadecane-5,9,10,14-tetrol.

Molecular Properties

Compound Nameoctadecane-5,9,10,14-tetrol
PubChem CID123917796
Molecular FormulaC18H38O4
Molecular Weight318.50 g/mol
Exact Mass318.28
IUPAC Nameoctadecane-5,9,10,14-tetrol
SMILESCCCCC(O)CCCC(O)C(O)CCCC(O)CCCC
InChIInChI=1S/C18H38O4/c1-3-5-9-15(19)11-7-13-17(21)18(22)14-8-12-16(20)10-6-4-2/h15-22H,3-14H2,1-2H3
InChIKeyGWOCZADCGKDYPZ-UHFFFAOYSA-N
XLogP3.15
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.50
LogP ≤ 53.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 172776718
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(5S)-octadecan-5-ol
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(3S,4S)-octane-3,4-diol
CID 132990515
icosane-5,10-diol
CID 170722579
(4R,8R)-undecane-4,8-diol
CID 101372142
heptane-1,2,3-triol;propane-1,2,3-triol
CID 141381425
nonacosane-7,20-diol
CID 174949468
icosan-9-ol
CID 11983377
(5R,7S)-undecane-5,7-diol
CID 10899409
tetratetracontan-22-ol
CID 91434437

Frequently Asked Questions

What is the IUPAC name of octadecane-5,9,10,14-tetrol?
The IUPAC name of octadecane-5,9,10,14-tetrol (CID 123917796) is octadecane-5,9,10,14-tetrol.
What is the SMILES notation for octadecane-5,9,10,14-tetrol?
The canonical SMILES for octadecane-5,9,10,14-tetrol is CCCCC(O)CCCC(O)C(O)CCCC(O)CCCC.
What is the InChIKey of octadecane-5,9,10,14-tetrol?
The InChIKey is GWOCZADCGKDYPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38O4/c1-3-5-9-15(19)11-7-13-17(21)18(22)14-8-12-16(20)10-6-4-2/h15-22H,3-14H2,1-2H3.
What are the key properties of octadecane-5,9,10,14-tetrol?
octadecane-5,9,10,14-tetrol has a molecular weight of 318.50 g/mol, XLogP of 3.15, 15 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for octadecane-5,9,10,14-tetrol is sourced from PubChem (CID 123917796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).