1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol

C9H10O — CID 170074800

IUPAC1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol
SMILESC=CC1=CC=C(C(=C)O)C1
InChIInChI=1S/C9H10O/c1-3-8-4-5-9(6-8)7(2)10/h3-5,10H,1-2,6H2
InChIKeyLXOJNEAXUSQKSH-UHFFFAOYSA-N
MW134.18 g/mol
LogP2.50
Rot. Bonds2

About 1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol

1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol (PubChem CID 170074800) has the molecular formula C9H10O and a molecular weight of 134.18 g/mol. Its IUPAC name is 1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol.

Molecular Properties

Compound Name1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol
PubChem CID170074800
Molecular FormulaC9H10O
Molecular Weight134.18 g/mol
Exact Mass134.07
IUPAC Name1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol
SMILESC=CC1=CC=C(C(=C)O)C1
InChIInChI=1S/C9H10O/c1-3-8-4-5-9(6-8)7(2)10/h3-5,10H,1-2,6H2
InChIKeyLXOJNEAXUSQKSH-UHFFFAOYSA-N
XLogP2.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol?
The IUPAC name of 1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol (CID 170074800) is 1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol.
What is the SMILES notation for 1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol?
The canonical SMILES for 1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol is C=CC1=CC=C(C(=C)O)C1.
What is the InChIKey of 1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol?
The InChIKey is LXOJNEAXUSQKSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O/c1-3-8-4-5-9(6-8)7(2)10/h3-5,10H,1-2,6H2.
What are the key properties of 1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol?
1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol has a molecular weight of 134.18 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethenylcyclopenta-1,3-dien-1-yl)ethenol is sourced from PubChem (CID 170074800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).