(3E)-undeca-1,3-dien-6-ol

C11H20O — CID 15579179

IUPAC(3E)-undeca-1,3-dien-6-ol
SMILESC=C/C=C/CC(O)CCCCC
InChIInChI=1S/C11H20O/c1-3-5-7-9-11(12)10-8-6-4-2/h3,5,7,11-12H,1,4,6,8-10H2,2H3/b7-5+
InChIKeyONUMTLZUIRMPBN-FNORWQNLSA-N
MW168.28 g/mol
LogP3.06
Rot. Bonds7

About (3E)-undeca-1,3-dien-6-ol

(3E)-undeca-1,3-dien-6-ol (PubChem CID 15579179) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is (3E)-undeca-1,3-dien-6-ol.

Molecular Properties

Compound Name(3E)-undeca-1,3-dien-6-ol
PubChem CID15579179
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name(3E)-undeca-1,3-dien-6-ol
SMILESC=C/C=C/CC(O)CCCCC
InChIInChI=1S/C11H20O/c1-3-5-7-9-11(12)10-8-6-4-2/h3,5,7,11-12H,1,4,6,8-10H2,2H3/b7-5+
InChIKeyONUMTLZUIRMPBN-FNORWQNLSA-N
XLogP3.06
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(6Z)-1-(methylamino)nona-6,8-dien-4-ol
CID 167004821
(4R)-dodec-1-en-4-ol
CID 11074077
(5E)-octa-5,7-dien-3-ol
CID 12576352
(Z)-tridec-2-en-5-ol
CID 11564658
(E)-octadec-1-ene-1,4-diol
CID 87483971
(E,5S)-tridec-2-en-5-ol
CID 87621618
(Z)-tridec-8-en-6-ol
CID 170849340
acetic acid;(13E)-hexadeca-13,15-dien-6-ol
CID 175333798
(E,10S)-henicos-7-en-10-ol
CID 14607531
(Z)-octadec-10-en-8-ol
CID 173051806
(Z)-pentadec-8-en-6-ol
CID 10398809
(E,7R,11R)-heptadec-8-ene-7,11-diol
CID 101453637

Frequently Asked Questions

What is the IUPAC name of (3E)-undeca-1,3-dien-6-ol?
The IUPAC name of (3E)-undeca-1,3-dien-6-ol (CID 15579179) is (3E)-undeca-1,3-dien-6-ol.
What is the SMILES notation for (3E)-undeca-1,3-dien-6-ol?
The canonical SMILES for (3E)-undeca-1,3-dien-6-ol is C=C/C=C/CC(O)CCCCC.
What is the InChIKey of (3E)-undeca-1,3-dien-6-ol?
The InChIKey is ONUMTLZUIRMPBN-FNORWQNLSA-N. The full InChI is InChI=1S/C11H20O/c1-3-5-7-9-11(12)10-8-6-4-2/h3,5,7,11-12H,1,4,6,8-10H2,2H3/b7-5+.
What are the key properties of (3E)-undeca-1,3-dien-6-ol?
(3E)-undeca-1,3-dien-6-ol has a molecular weight of 168.28 g/mol, XLogP of 3.06, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-undeca-1,3-dien-6-ol is sourced from PubChem (CID 15579179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).