1-hex-5-enylcyclohexan-1-ol

C12H22O — CID 11019510

IUPAC1-hex-5-enylcyclohexan-1-ol
SMILESC=CCCCCC1(O)CCCCC1
InChIInChI=1S/C12H22O/c1-2-3-4-6-9-12(13)10-7-5-8-11-12/h2,13H,1,3-11H2
InChIKeyMQWMZYBADLYEGK-UHFFFAOYSA-N
MW182.31 g/mol
LogP3.43
Rot. Bonds5

About 1-hex-5-enylcyclohexan-1-ol

1-hex-5-enylcyclohexan-1-ol (PubChem CID 11019510) has the molecular formula C12H22O and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-hex-5-enylcyclohexan-1-ol.

Molecular Properties

Compound Name1-hex-5-enylcyclohexan-1-ol
PubChem CID11019510
Molecular FormulaC12H22O
Molecular Weight182.31 g/mol
Exact Mass182.17
IUPAC Name1-hex-5-enylcyclohexan-1-ol
SMILESC=CCCCCC1(O)CCCCC1
InChIInChI=1S/C12H22O/c1-2-3-4-6-9-12(13)10-7-5-8-11-12/h2,13H,1,3-11H2
InChIKeyMQWMZYBADLYEGK-UHFFFAOYSA-N
XLogP3.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 53.43
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

1-Vinylcyclohexyl alcohol
CID 74741
1-Allyl-1-cyclohexanol
CID 79145
3,7-Dimethyl-7-octen-3-ol
CID 557859
11-Dodecen-2-ol, 2-methyl-
CID 118672
4-Methylidene-1-propan-2-ylcyclohexan-1-ol
CID 10197791
2-Cyclohexylpent-4-en-2-ol
CID 15497572
1-Vinylcyclododecanol
CID 543425
Cyclohexanol, 1-(2-methyl-2-propenyl)-
CID 10898910
1-(Prop-2-en-1-yl)cycloheptan-1-ol
CID 11535599
Cyclododecanol, 1-(2-propenyl)-
CID 11770111
4-Methylnon-1-en-4-ol
CID 12504822
3-Ethyloct-7-en-3-ol
CID 57261069

Frequently Asked Questions

What is the IUPAC name of 1-hex-5-enylcyclohexan-1-ol?
The IUPAC name of 1-hex-5-enylcyclohexan-1-ol (CID 11019510) is 1-hex-5-enylcyclohexan-1-ol.
What is the SMILES notation for 1-hex-5-enylcyclohexan-1-ol?
The canonical SMILES for 1-hex-5-enylcyclohexan-1-ol is C=CCCCCC1(O)CCCCC1.
What is the InChIKey of 1-hex-5-enylcyclohexan-1-ol?
The InChIKey is MQWMZYBADLYEGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O/c1-2-3-4-6-9-12(13)10-7-5-8-11-12/h2,13H,1,3-11H2.
What are the key properties of 1-hex-5-enylcyclohexan-1-ol?
1-hex-5-enylcyclohexan-1-ol has a molecular weight of 182.31 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hex-5-enylcyclohexan-1-ol is sourced from PubChem (CID 11019510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).