(4Z)-4-butylidenecyclohexa-1,5-dien-1-ol

C10H14O — CID 18606870

IUPAC(4Z)-4-butylidenecyclohexa-1,5-dien-1-ol
SMILESCCC/C=C1\C=CC(O)=CC1
InChIInChI=1S/C10H14O/c1-2-3-4-9-5-7-10(11)8-6-9/h4-5,7-8,11H,2-3,6H2,1H3/b9-4+
InChIKeyPCAXHPOVNHEVJO-RUDMXATFSA-N
MW150.22 g/mol
LogP3.11
Rot. Bonds2

About (4Z)-4-butylidenecyclohexa-1,5-dien-1-ol

(4Z)-4-butylidenecyclohexa-1,5-dien-1-ol (PubChem CID 18606870) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is (4Z)-4-butylidenecyclohexa-1,5-dien-1-ol.

Molecular Properties

Compound Name(4Z)-4-butylidenecyclohexa-1,5-dien-1-ol
PubChem CID18606870
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name(4Z)-4-butylidenecyclohexa-1,5-dien-1-ol
SMILESCCC/C=C1\C=CC(O)=CC1
InChIInChI=1S/C10H14O/c1-2-3-4-9-5-7-10(11)8-6-9/h4-5,7-8,11H,2-3,6H2,1H3/b9-4+
InChIKeyPCAXHPOVNHEVJO-RUDMXATFSA-N
XLogP3.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-butylidenecyclohexa-1,5-dien-1-ol?
The IUPAC name of (4Z)-4-butylidenecyclohexa-1,5-dien-1-ol (CID 18606870) is (4Z)-4-butylidenecyclohexa-1,5-dien-1-ol.
What is the SMILES notation for (4Z)-4-butylidenecyclohexa-1,5-dien-1-ol?
The canonical SMILES for (4Z)-4-butylidenecyclohexa-1,5-dien-1-ol is CCC/C=C1\C=CC(O)=CC1.
What is the InChIKey of (4Z)-4-butylidenecyclohexa-1,5-dien-1-ol?
The InChIKey is PCAXHPOVNHEVJO-RUDMXATFSA-N. The full InChI is InChI=1S/C10H14O/c1-2-3-4-9-5-7-10(11)8-6-9/h4-5,7-8,11H,2-3,6H2,1H3/b9-4+.
What are the key properties of (4Z)-4-butylidenecyclohexa-1,5-dien-1-ol?
(4Z)-4-butylidenecyclohexa-1,5-dien-1-ol has a molecular weight of 150.22 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-butylidenecyclohexa-1,5-dien-1-ol is sourced from PubChem (CID 18606870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).