(3S,4Z)-undeca-1,4-dien-3-ol

C11H20O — CID 129408350

IUPAC(3S,4Z)-undeca-1,4-dien-3-ol
SMILESC=C[C@H](O)/C=C\CCCCCC
InChIInChI=1S/C11H20O/c1-3-5-6-7-8-9-10-11(12)4-2/h4,9-12H,2-3,5-8H2,1H3/b10-9-/t11-/m0/s1
InChIKeyJYOVMDPIGLTFMW-JUDLJHIGSA-N
MW168.28 g/mol
LogP3.06
Rot. Bonds7

About (3S,4Z)-undeca-1,4-dien-3-ol

(3S,4Z)-undeca-1,4-dien-3-ol (PubChem CID 129408350) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is (3S,4Z)-undeca-1,4-dien-3-ol.

Molecular Properties

Compound Name(3S,4Z)-undeca-1,4-dien-3-ol
PubChem CID129408350
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name(3S,4Z)-undeca-1,4-dien-3-ol
SMILESC=C[C@H](O)/C=C\CCCCCC
InChIInChI=1S/C11H20O/c1-3-5-6-7-8-9-10-11(12)4-2/h4,9-12H,2-3,5-8H2,1H3/b10-9-/t11-/m0/s1
InChIKeyJYOVMDPIGLTFMW-JUDLJHIGSA-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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(4E,9Z)-heptadeca-1,4,9-trien-6-yn-3-ol
CID 15736263
undec-3-en-2-ol
CID 174515693
(3R,9Z)-heptadeca-1,9-dien-4,6-diyne-3,8-diol
CID 102184429
(3R,8S,9Z)-heptadeca-1,9-dien-4,6-diyne-3,8-diol;(3R,8S,9E)-heptadeca-1,9-dien-4,6-diyne-3,8-diol
CID 87532668
(Z,2R)-non-3-en-2-ol
CID 11040800
(E,2S,3S)-3-methylundec-4-en-2-ol
CID 10465011
deca-1,5-diene-3,4-diol
CID 130238346
(E,2S)-dec-3-ene-1,2-diol
CID 101192698
henicos-7-en-6-ol
CID 91409967
(E)-1-aminodec-3-en-2-ol
CID 101275263
(Z)-1-bromododec-4-en-1-yn-3-ol
CID 134856436
(6Z,10E)-8-methylideneheptadeca-6,10-dien-9-ol
CID 10468022

Frequently Asked Questions

What is the IUPAC name of (3S,4Z)-undeca-1,4-dien-3-ol?
The IUPAC name of (3S,4Z)-undeca-1,4-dien-3-ol (CID 129408350) is (3S,4Z)-undeca-1,4-dien-3-ol.
What is the SMILES notation for (3S,4Z)-undeca-1,4-dien-3-ol?
The canonical SMILES for (3S,4Z)-undeca-1,4-dien-3-ol is C=C[C@H](O)/C=C\CCCCCC.
What is the InChIKey of (3S,4Z)-undeca-1,4-dien-3-ol?
The InChIKey is JYOVMDPIGLTFMW-JUDLJHIGSA-N. The full InChI is InChI=1S/C11H20O/c1-3-5-6-7-8-9-10-11(12)4-2/h4,9-12H,2-3,5-8H2,1H3/b10-9-/t11-/m0/s1.
What are the key properties of (3S,4Z)-undeca-1,4-dien-3-ol?
(3S,4Z)-undeca-1,4-dien-3-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 (3S,4Z)-undeca-1,4-dien-3-ol is sourced from PubChem (CID 129408350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).