ethane;4-ethenylcyclohexa-1,3-dien-1-ol

C10H16O — CID 144909914

IUPACethane;4-ethenylcyclohexa-1,3-dien-1-ol
SMILESC=CC1=CC=C(O)CC1.CC
InChIInChI=1S/C8H10O.C2H6/c1-2-7-3-5-8(9)6-4-7;1-2/h2-3,5,9H,1,4,6H2;1-2H3
InChIKeyWRFJZYQKOWLDNN-UHFFFAOYSA-N
MW152.24 g/mol
LogP3.36
Rot. Bonds1

About ethane;4-ethenylcyclohexa-1,3-dien-1-ol

ethane;4-ethenylcyclohexa-1,3-dien-1-ol (PubChem CID 144909914) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is ethane;4-ethenylcyclohexa-1,3-dien-1-ol.

Molecular Properties

Compound Nameethane;4-ethenylcyclohexa-1,3-dien-1-ol
PubChem CID144909914
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Nameethane;4-ethenylcyclohexa-1,3-dien-1-ol
SMILESC=CC1=CC=C(O)CC1.CC
InChIInChI=1S/C8H10O.C2H6/c1-2-7-3-5-8(9)6-4-7;1-2/h2-3,5,9H,1,4,6H2;1-2H3
InChIKeyWRFJZYQKOWLDNN-UHFFFAOYSA-N
XLogP3.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze ethane;4-ethenylcyclohexa-1,3-dien-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethane;4-ethenylcyclohexa-1,3-dien-1-ol?
The IUPAC name of ethane;4-ethenylcyclohexa-1,3-dien-1-ol (CID 144909914) is ethane;4-ethenylcyclohexa-1,3-dien-1-ol.
What is the SMILES notation for ethane;4-ethenylcyclohexa-1,3-dien-1-ol?
The canonical SMILES for ethane;4-ethenylcyclohexa-1,3-dien-1-ol is C=CC1=CC=C(O)CC1.CC.
What is the InChIKey of ethane;4-ethenylcyclohexa-1,3-dien-1-ol?
The InChIKey is WRFJZYQKOWLDNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O.C2H6/c1-2-7-3-5-8(9)6-4-7;1-2/h2-3,5,9H,1,4,6H2;1-2H3.
What are the key properties of ethane;4-ethenylcyclohexa-1,3-dien-1-ol?
ethane;4-ethenylcyclohexa-1,3-dien-1-ol has a molecular weight of 152.24 g/mol, XLogP of 3.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethenylcyclohexa-1,3-dien-1-ol is sourced from PubChem (CID 144909914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).