1-(1-ethoxyethenyl)cyclohex-2-en-1-ol

C10H16O2 — CID 53381841

IUPAC1-(1-ethoxyethenyl)cyclohex-2-en-1-ol
SMILESC=C(OCC)C1(O)C=CCCC1
InChIInChI=1S/C10H16O2/c1-3-12-9(2)10(11)7-5-4-6-8-10/h5,7,11H,2-4,6,8H2,1H3
InChIKeyHFFUNOJVXUBVER-UHFFFAOYSA-N
MW168.24 g/mol
LogP2.01
Rot. Bonds3

About 1-(1-ethoxyethenyl)cyclohex-2-en-1-ol

1-(1-ethoxyethenyl)cyclohex-2-en-1-ol (PubChem CID 53381841) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 1-(1-ethoxyethenyl)cyclohex-2-en-1-ol.

Molecular Properties

Compound Name1-(1-ethoxyethenyl)cyclohex-2-en-1-ol
PubChem CID53381841
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name1-(1-ethoxyethenyl)cyclohex-2-en-1-ol
SMILESC=C(OCC)C1(O)C=CCCC1
InChIInChI=1S/C10H16O2/c1-3-12-9(2)10(11)7-5-4-6-8-10/h5,7,11H,2-4,6,8H2,1H3
InChIKeyHFFUNOJVXUBVER-UHFFFAOYSA-N
XLogP2.01
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethoxyethenyl)cyclohex-2-en-1-ol?
The IUPAC name of 1-(1-ethoxyethenyl)cyclohex-2-en-1-ol (CID 53381841) is 1-(1-ethoxyethenyl)cyclohex-2-en-1-ol.
What is the SMILES notation for 1-(1-ethoxyethenyl)cyclohex-2-en-1-ol?
The canonical SMILES for 1-(1-ethoxyethenyl)cyclohex-2-en-1-ol is C=C(OCC)C1(O)C=CCCC1.
What is the InChIKey of 1-(1-ethoxyethenyl)cyclohex-2-en-1-ol?
The InChIKey is HFFUNOJVXUBVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-3-12-9(2)10(11)7-5-4-6-8-10/h5,7,11H,2-4,6,8H2,1H3.
What are the key properties of 1-(1-ethoxyethenyl)cyclohex-2-en-1-ol?
1-(1-ethoxyethenyl)cyclohex-2-en-1-ol has a molecular weight of 168.24 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethoxyethenyl)cyclohex-2-en-1-ol is sourced from PubChem (CID 53381841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).