(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol

C16H26O3 — CID 10683195

IUPAC(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol
SMILESC/C(=C/CO)C(C)CCC1=CCCCC12OCCO2
InChIInChI=1S/C16H26O3/c1-13(14(2)8-10-17)6-7-15-5-3-4-9-16(15)18-11-12-19-16/h5,8,13,17H,3-4,6-7,9-12H2,1-2H3/b14-8-
InChIKeyRWRDQCAMINDHFN-ZSOIEALJSA-N
MW266.38 g/mol
LogP3.19
Rot. Bonds5

About (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol

(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol (PubChem CID 10683195) has the molecular formula C16H26O3 and a molecular weight of 266.38 g/mol. Its IUPAC name is (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol.

Molecular Properties

Compound Name(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol
PubChem CID10683195
Molecular FormulaC16H26O3
Molecular Weight266.38 g/mol
Exact Mass266.19
IUPAC Name(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol
SMILESC/C(=C/CO)C(C)CCC1=CCCCC12OCCO2
InChIInChI=1S/C16H26O3/c1-13(14(2)8-10-17)6-7-15-5-3-4-9-16(15)18-11-12-19-16/h5,8,13,17H,3-4,6-7,9-12H2,1-2H3/b14-8-
InChIKeyRWRDQCAMINDHFN-ZSOIEALJSA-N
XLogP3.19
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol with MolForge

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Launch Full Analysis

Related Compounds

Perillaldehyde propyleneglycol acetal
CID 71587448
2-(1,4-Dioxaspiro[4.5]dec-6-en-6-yl)propan-2-ol
CID 101702211
(4R,6R)-6-[(3aR,7aS)-2,2,7-trimethyl-3a,7a-dihydro-1,3-benzodioxol-4-yl]-2-methylhept-2-en-4-ol
CID 139256437
7,9,9-Trimethyl-8-propan-2-yl-1,4-dioxaspiro[4.5]dec-6-en-8-ol
CID 85732284
2-methyl-2-[(4R)-4-methylcyclohexen-1-yl]-1,3-dioxolane
CID 139467954
(2Z)-2-[(6S)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylcyclohex-3-en-1-ylidene]ethanol
CID 11107412
cis-(1R,2R)-1-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-2-prop-1-en-2-ylcyclohexan-1-ol
CID 11808039
(E)-3-methyl-4-[(1S)-1-methyl-3-(2,5,5-trimethyl-1,3-dioxan-2-yl)cyclopent-2-en-1-yl]but-2-en-1-ol
CID 71492109
7,8-Dimethyl-1,4-dioxaspiro[4.5]dec-6-ene
CID 131852235
4-Butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol
CID 134890243
(2Z)-2-[6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylcyclohex-3-en-1-ylidene]ethanol
CID 135042599
(4S,6S)-6-[(3aR,7aS)-2,2,7-trimethyl-3a,7a-dihydro-1,3-benzodioxol-4-yl]-2-methylhept-2-en-4-ol
CID 139256439

Frequently Asked Questions

What is the IUPAC name of (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol?
The IUPAC name of (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol (CID 10683195) is (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol.
What is the SMILES notation for (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol?
The canonical SMILES for (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol is C/C(=C/CO)C(C)CCC1=CCCCC12OCCO2.
What is the InChIKey of (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol?
The InChIKey is RWRDQCAMINDHFN-ZSOIEALJSA-N. The full InChI is InChI=1S/C16H26O3/c1-13(14(2)8-10-17)6-7-15-5-3-4-9-16(15)18-11-12-19-16/h5,8,13,17H,3-4,6-7,9-12H2,1-2H3/b14-8-.
What are the key properties of (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol?
(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol has a molecular weight of 266.38 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-en-1-ol is sourced from PubChem (CID 10683195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).