(5Z)-4,4-dimethylocta-1,5-dien-3-ol

C10H18O — CID 173450369

IUPAC(5Z)-4,4-dimethylocta-1,5-dien-3-ol
SMILESC=CC(O)C(C)(C)/C=C\CC
InChIInChI=1S/C10H18O/c1-5-7-8-10(3,4)9(11)6-2/h6-9,11H,2,5H2,1,3-4H3/b8-7-
InChIKeyWDMNCHHPJBJXHU-FPLPWBNLSA-N
MW154.25 g/mol
LogP2.53
Rot. Bonds4

About (5Z)-4,4-dimethylocta-1,5-dien-3-ol

(5Z)-4,4-dimethylocta-1,5-dien-3-ol (PubChem CID 173450369) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (5Z)-4,4-dimethylocta-1,5-dien-3-ol.

Molecular Properties

Compound Name(5Z)-4,4-dimethylocta-1,5-dien-3-ol
PubChem CID173450369
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(5Z)-4,4-dimethylocta-1,5-dien-3-ol
SMILESC=CC(O)C(C)(C)/C=C\CC
InChIInChI=1S/C10H18O/c1-5-7-8-10(3,4)9(11)6-2/h6-9,11H,2,5H2,1,3-4H3/b8-7-
InChIKeyWDMNCHHPJBJXHU-FPLPWBNLSA-N
XLogP2.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-2,2-dimethylhex-3-ene
CID 5357261
(3S)-4-methyl-4-sulfanylpent-1-en-3-ol
CID 90370975
(E)-but-1-en-1-ol;2-methylbut-3-en-2-ol
CID 141182868
(4E,7S)-2-diethoxyphosphoryl-7-hydroxy-6,6-dimethylnona-4,8-dien-3-one
CID 71601287
(Z)-4,4-difluorooct-5-en-3-ol
CID 173450253
(Z,3S)-2,2-dimethyloct-5-en-3-ol
CID 158993926
(E)-2-(methylamino)hex-3-en-2-ol
CID 152934971
2-ethyl-2-methyl-1-(3-methylpentan-3-ylamino)hex-3-en-1-ol
CID 146521804
3-ethyloct-5-ene-3,4-diol
CID 54450171
(Z)-2-hydroxy-2-methylhex-3-enamide
CID 146609859
(5E)-4-tert-butyl-4-methylocta-1,5-diene
CID 22133460
6-ethyl-4,4,5-trifluoroocta-1,5-dien-3-ol
CID 15896423

Frequently Asked Questions

What is the IUPAC name of (5Z)-4,4-dimethylocta-1,5-dien-3-ol?
The IUPAC name of (5Z)-4,4-dimethylocta-1,5-dien-3-ol (CID 173450369) is (5Z)-4,4-dimethylocta-1,5-dien-3-ol.
What is the SMILES notation for (5Z)-4,4-dimethylocta-1,5-dien-3-ol?
The canonical SMILES for (5Z)-4,4-dimethylocta-1,5-dien-3-ol is C=CC(O)C(C)(C)/C=C\CC.
What is the InChIKey of (5Z)-4,4-dimethylocta-1,5-dien-3-ol?
The InChIKey is WDMNCHHPJBJXHU-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H18O/c1-5-7-8-10(3,4)9(11)6-2/h6-9,11H,2,5H2,1,3-4H3/b8-7-.
What are the key properties of (5Z)-4,4-dimethylocta-1,5-dien-3-ol?
(5Z)-4,4-dimethylocta-1,5-dien-3-ol has a molecular weight of 154.25 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-4,4-dimethylocta-1,5-dien-3-ol is sourced from PubChem (CID 173450369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).