(Z,2E)-2-ethylidenehex-3-en-1-ol

C8H14O — CID 88957567

IUPAC(Z,2E)-2-ethylidenehex-3-en-1-ol
SMILESC/C=C(\C=C/CC)CO
InChIInChI=1S/C8H14O/c1-3-5-6-8(4-2)7-9/h4-6,9H,3,7H2,1-2H3/b6-5-,8-4+
InChIKeyNXKGOGPDOFNLMY-QNMAEOQASA-N
MW126.20 g/mol
LogP1.89
Rot. Bonds3

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

(Z,2E)-2-ethylidenehex-3-en-1-ol (PubChem CID 88957567) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is (Z,2E)-2-ethylidenehex-3-en-1-ol.

Molecular Properties

Compound Name(Z,2E)-2-ethylidenehex-3-en-1-ol
PubChem CID88957567
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name(Z,2E)-2-ethylidenehex-3-en-1-ol
SMILESC/C=C(\C=C/CC)CO
InChIInChI=1S/C8H14O/c1-3-5-6-8(4-2)7-9/h4-6,9H,3,7H2,1-2H3/b6-5-,8-4+
InChIKeyNXKGOGPDOFNLMY-QNMAEOQASA-N
XLogP1.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.89
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-ethylidenehex-3-en-1-ol?
The IUPAC name of (Z,2E)-2-ethylidenehex-3-en-1-ol (CID 88957567) is (Z,2E)-2-ethylidenehex-3-en-1-ol.
What is the SMILES notation for (Z,2E)-2-ethylidenehex-3-en-1-ol?
The canonical SMILES for (Z,2E)-2-ethylidenehex-3-en-1-ol is C/C=C(\C=C/CC)CO.
What is the InChIKey of (Z,2E)-2-ethylidenehex-3-en-1-ol?
The InChIKey is NXKGOGPDOFNLMY-QNMAEOQASA-N. The full InChI is InChI=1S/C8H14O/c1-3-5-6-8(4-2)7-9/h4-6,9H,3,7H2,1-2H3/b6-5-,8-4+.
What are the key properties of (Z,2E)-2-ethylidenehex-3-en-1-ol?
(Z,2E)-2-ethylidenehex-3-en-1-ol has a molecular weight of 126.20 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2E)-2-ethylidenehex-3-en-1-ol is sourced from PubChem (CID 88957567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).