5-(furan-2-yl)nona-1,8-dien-5-ol

C13H18O2 — CID 101465599

IUPAC5-(furan-2-yl)nona-1,8-dien-5-ol
SMILESC=CCCC(O)(CCC=C)c1ccco1
InChIInChI=1S/C13H18O2/c1-3-5-9-13(14,10-6-4-2)12-8-7-11-15-12/h3-4,7-8,11,14H,1-2,5-6,9-10H2
InChIKeyZZWFSADTTSQXPZ-UHFFFAOYSA-N
MW206.28 g/mol
LogP3.40
Rot. Bonds7

About 5-(furan-2-yl)nona-1,8-dien-5-ol

5-(furan-2-yl)nona-1,8-dien-5-ol (PubChem CID 101465599) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 5-(furan-2-yl)nona-1,8-dien-5-ol.

Molecular Properties

Compound Name5-(furan-2-yl)nona-1,8-dien-5-ol
PubChem CID101465599
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name5-(furan-2-yl)nona-1,8-dien-5-ol
SMILESC=CCCC(O)(CCC=C)c1ccco1
InChIInChI=1S/C13H18O2/c1-3-5-9-13(14,10-6-4-2)12-8-7-11-15-12/h3-4,7-8,11,14H,1-2,5-6,9-10H2
InChIKeyZZWFSADTTSQXPZ-UHFFFAOYSA-N
XLogP3.40
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1,1,1-trifluoro-2-(furan-2-yl)pent-4-en-2-ol
CID 162772868
2-but-3-enylfuran
CID 11977163
3-(furan-2-yl)-N,3-dimethylbutan-1-amine
CID 79830783
(2S)-2-amino-2-(furan-2-yl)propan-1-ol
CID 130605290
3-ethyl-2-[2-(furan-2-yl)-2-hydroxypropyl]-1-hept-6-enyl-1-methylguanidine
CID 109484169
3,3,3-trifluoro-2-(furan-2-yl)propane-1,2-diol
CID 73069117
1-[2-(furan-2-yl)-2-hydroxypropyl]-2-methyl-3-prop-2-enylguanidine
CID 119139399
2-(furan-2-yl)-4-methoxybutan-2-ol
CID 63949969
tris(furan-2-yl)methylsilane
CID 71354015
bis(furan-2-yl)methanediamine
CID 175922439
2-(furan-2-yl)propan-2-ol;methoxymethane
CID 174924617
4-(tert-butylamino)-2-(furan-2-yl)butan-2-ol
CID 66001662

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)nona-1,8-dien-5-ol?
The IUPAC name of 5-(furan-2-yl)nona-1,8-dien-5-ol (CID 101465599) is 5-(furan-2-yl)nona-1,8-dien-5-ol.
What is the SMILES notation for 5-(furan-2-yl)nona-1,8-dien-5-ol?
The canonical SMILES for 5-(furan-2-yl)nona-1,8-dien-5-ol is C=CCCC(O)(CCC=C)c1ccco1.
What is the InChIKey of 5-(furan-2-yl)nona-1,8-dien-5-ol?
The InChIKey is ZZWFSADTTSQXPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-3-5-9-13(14,10-6-4-2)12-8-7-11-15-12/h3-4,7-8,11,14H,1-2,5-6,9-10H2.
What are the key properties of 5-(furan-2-yl)nona-1,8-dien-5-ol?
5-(furan-2-yl)nona-1,8-dien-5-ol has a molecular weight of 206.28 g/mol, XLogP of 3.40, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)nona-1,8-dien-5-ol is sourced from PubChem (CID 101465599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).