4-ethenylcyclohexa-2,4-dien-1-ol

C8H10O — CID 89298961

IUPAC4-ethenylcyclohexa-2,4-dien-1-ol
SMILESC=CC1=CCC(O)C=C1
InChIInChI=1S/C8H10O/c1-2-7-3-5-8(9)6-4-7/h2-5,8-9H,1,6H2
InChIKeyOJCJXAFEYLJNRF-UHFFFAOYSA-N
MW122.17 g/mol
LogP1.42
Rot. Bonds1

About 4-ethenylcyclohexa-2,4-dien-1-ol

4-ethenylcyclohexa-2,4-dien-1-ol (PubChem CID 89298961) has the molecular formula C8H10O and a molecular weight of 122.17 g/mol. Its IUPAC name is 4-ethenylcyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name4-ethenylcyclohexa-2,4-dien-1-ol
PubChem CID89298961
Molecular FormulaC8H10O
Molecular Weight122.17 g/mol
Exact Mass122.07
IUPAC Name4-ethenylcyclohexa-2,4-dien-1-ol
SMILESC=CC1=CCC(O)C=C1
InChIInChI=1S/C8H10O/c1-2-7-3-5-8(9)6-4-7/h2-5,8-9H,1,6H2
InChIKeyOJCJXAFEYLJNRF-UHFFFAOYSA-N
XLogP1.42
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethenylcyclohexa-2,4-dien-1-ol?
The IUPAC name of 4-ethenylcyclohexa-2,4-dien-1-ol (CID 89298961) is 4-ethenylcyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 4-ethenylcyclohexa-2,4-dien-1-ol?
The canonical SMILES for 4-ethenylcyclohexa-2,4-dien-1-ol is C=CC1=CCC(O)C=C1.
What is the InChIKey of 4-ethenylcyclohexa-2,4-dien-1-ol?
The InChIKey is OJCJXAFEYLJNRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O/c1-2-7-3-5-8(9)6-4-7/h2-5,8-9H,1,6H2.
What are the key properties of 4-ethenylcyclohexa-2,4-dien-1-ol?
4-ethenylcyclohexa-2,4-dien-1-ol has a molecular weight of 122.17 g/mol, XLogP of 1.42, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenylcyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 89298961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).