(Z,2E)-2-prop-2-enylidenehex-3-en-1-ol

C9H14O — CID 89416445

IUPAC(Z,2E)-2-prop-2-enylidenehex-3-en-1-ol
SMILESC=C/C=C(\C=C/CC)CO
InChIInChI=1S/C9H14O/c1-3-5-7-9(8-10)6-4-2/h4-7,10H,2-3,8H2,1H3/b7-5-,9-6+
InChIKeyOXYRUJAUQVYOPM-XCZNYUDNSA-N
MW138.21 g/mol
LogP2.06
Rot. Bonds4

About (Z,2E)-2-prop-2-enylidenehex-3-en-1-ol

(Z,2E)-2-prop-2-enylidenehex-3-en-1-ol (PubChem CID 89416445) has the molecular formula C9H14O and a molecular weight of 138.21 g/mol. Its IUPAC name is (Z,2E)-2-prop-2-enylidenehex-3-en-1-ol.

Molecular Properties

Compound Name(Z,2E)-2-prop-2-enylidenehex-3-en-1-ol
PubChem CID89416445
Molecular FormulaC9H14O
Molecular Weight138.21 g/mol
Exact Mass138.10
IUPAC Name(Z,2E)-2-prop-2-enylidenehex-3-en-1-ol
SMILESC=C/C=C(\C=C/CC)CO
InChIInChI=1S/C9H14O/c1-3-5-7-9(8-10)6-4-2/h4-7,10H,2-3,8H2,1H3/b7-5-,9-6+
InChIKeyOXYRUJAUQVYOPM-XCZNYUDNSA-N
XLogP2.06
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z,2E)-2-prop-2-enylidenehex-3-en-1-ol?
The IUPAC name of (Z,2E)-2-prop-2-enylidenehex-3-en-1-ol (CID 89416445) is (Z,2E)-2-prop-2-enylidenehex-3-en-1-ol.
What is the SMILES notation for (Z,2E)-2-prop-2-enylidenehex-3-en-1-ol?
The canonical SMILES for (Z,2E)-2-prop-2-enylidenehex-3-en-1-ol is C=C/C=C(\C=C/CC)CO.
What is the InChIKey of (Z,2E)-2-prop-2-enylidenehex-3-en-1-ol?
The InChIKey is OXYRUJAUQVYOPM-XCZNYUDNSA-N. The full InChI is InChI=1S/C9H14O/c1-3-5-7-9(8-10)6-4-2/h4-7,10H,2-3,8H2,1H3/b7-5-,9-6+.
What are the key properties of (Z,2E)-2-prop-2-enylidenehex-3-en-1-ol?
(Z,2E)-2-prop-2-enylidenehex-3-en-1-ol has a molecular weight of 138.21 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2E)-2-prop-2-enylidenehex-3-en-1-ol is sourced from PubChem (CID 89416445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).