(Z)-oct-5-en-7-yn-1-ol

C8H12O — CID 13293587

IUPAC(Z)-oct-5-en-7-yn-1-ol
SMILESC#C/C=C\CCCCO
InChIInChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h1,3-4,9H,5-8H2/b4-3-
InChIKeyMPVHACWELDAXCS-ARJAWSKDSA-N
MW124.18 g/mol
LogP1.34
Rot. Bonds4

About (Z)-oct-5-en-7-yn-1-ol

(Z)-oct-5-en-7-yn-1-ol (PubChem CID 13293587) has the molecular formula C8H12O and a molecular weight of 124.18 g/mol. Its IUPAC name is (Z)-oct-5-en-7-yn-1-ol.

Molecular Properties

Compound Name(Z)-oct-5-en-7-yn-1-ol
PubChem CID13293587
Molecular FormulaC8H12O
Molecular Weight124.18 g/mol
Exact Mass124.09
IUPAC Name(Z)-oct-5-en-7-yn-1-ol
SMILESC#C/C=C\CCCCO
InChIInChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h1,3-4,9H,5-8H2/b4-3-
InChIKeyMPVHACWELDAXCS-ARJAWSKDSA-N
XLogP1.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.18
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3Z,9Z)-dodeca-3,9-dien-1,11-diyne
CID 11693943
(3E,13E)-hexadeca-3,13-dien-1,15-diyne
CID 101416454
non-3-en-1-yne
CID 556159
hexadec-8-ene-1,16-diol
CID 54395986
heptacosa-3,23-dien-1,25-diyne
CID 71349303
(7Z,11Z)-octadeca-7,11-diene-1,18-diol
CID 171904791
(9E)-tetradeca-9,13-dien-11-yn-1-ol
CID 15705025
(3Z,5R,15Z,27Z)-triaconta-3,15,27-trien-1,29-diyn-5-ol
CID 10455056
(E)-hexadec-1-ene-1,16-diol
CID 57427575
heptadec-1-ene-1,17-diol
CID 142730253
tricos-20-en-3,5,10,12,22-pentayne-1,2-diol
CID 74051672
sodium;(E)-hept-1-ene-1,7-diol;hydride
CID 174548415

Frequently Asked Questions

What is the IUPAC name of (Z)-oct-5-en-7-yn-1-ol?
The IUPAC name of (Z)-oct-5-en-7-yn-1-ol (CID 13293587) is (Z)-oct-5-en-7-yn-1-ol.
What is the SMILES notation for (Z)-oct-5-en-7-yn-1-ol?
The canonical SMILES for (Z)-oct-5-en-7-yn-1-ol is C#C/C=C\CCCCO.
What is the InChIKey of (Z)-oct-5-en-7-yn-1-ol?
The InChIKey is MPVHACWELDAXCS-ARJAWSKDSA-N. The full InChI is InChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h1,3-4,9H,5-8H2/b4-3-.
What are the key properties of (Z)-oct-5-en-7-yn-1-ol?
(Z)-oct-5-en-7-yn-1-ol has a molecular weight of 124.18 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-oct-5-en-7-yn-1-ol is sourced from PubChem (CID 13293587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).