(Z)-1-methoxyhex-3-ene

C7H14O — CID 5364230

IUPAC(Z)-1-methoxyhex-3-ene
SMILESCC/C=C\CCOC
InChIInChI=1S/C7H14O/c1-3-4-5-6-7-8-2/h4-5H,3,6-7H2,1-2H3/b5-4-
InChIKeyKUPODEXLSGEWFR-PLNGDYQASA-N
MW114.19 g/mol
LogP1.99
Rot. Bonds4

About (Z)-1-methoxyhex-3-ene

(Z)-1-methoxyhex-3-ene (PubChem CID 5364230) has the molecular formula C7H14O and a molecular weight of 114.19 g/mol. Its IUPAC name is (Z)-1-methoxyhex-3-ene.

Molecular Properties

Compound Name(Z)-1-methoxyhex-3-ene
PubChem CID5364230
Molecular FormulaC7H14O
Molecular Weight114.19 g/mol
Exact Mass114.10
IUPAC Name(Z)-1-methoxyhex-3-ene
SMILESCC/C=C\CCOC
InChIInChI=1S/C7H14O/c1-3-4-5-6-7-8-2/h4-5H,3,6-7H2,1-2H3/b5-4-
InChIKeyKUPODEXLSGEWFR-PLNGDYQASA-N
XLogP1.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-methoxyhex-3-ene?
The IUPAC name of (Z)-1-methoxyhex-3-ene (CID 5364230) is (Z)-1-methoxyhex-3-ene.
What is the SMILES notation for (Z)-1-methoxyhex-3-ene?
The canonical SMILES for (Z)-1-methoxyhex-3-ene is CC/C=C\CCOC.
What is the InChIKey of (Z)-1-methoxyhex-3-ene?
The InChIKey is KUPODEXLSGEWFR-PLNGDYQASA-N. The full InChI is InChI=1S/C7H14O/c1-3-4-5-6-7-8-2/h4-5H,3,6-7H2,1-2H3/b5-4-.
What are the key properties of (Z)-1-methoxyhex-3-ene?
(Z)-1-methoxyhex-3-ene has a molecular weight of 114.19 g/mol, XLogP of 1.99, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-methoxyhex-3-ene is sourced from PubChem (CID 5364230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).