5-ethenoxypent-1-ene

C7H12O — CID 13130298

IUPAC5-ethenoxypent-1-ene
SMILESC=CCCCOC=C
InChIInChI=1S/C7H12O/c1-3-5-6-7-8-4-2/h3-4H,1-2,5-7H2
InChIKeyVFOONMUUZUQJEU-UHFFFAOYSA-N
MW112.17 g/mol
LogP2.11
Rot. Bonds5

About 5-ethenoxypent-1-ene

5-ethenoxypent-1-ene (PubChem CID 13130298) has the molecular formula C7H12O and a molecular weight of 112.17 g/mol. Its IUPAC name is 5-ethenoxypent-1-ene.

Molecular Properties

Compound Name5-ethenoxypent-1-ene
PubChem CID13130298
Molecular FormulaC7H12O
Molecular Weight112.17 g/mol
Exact Mass112.09
IUPAC Name5-ethenoxypent-1-ene
SMILESC=CCCCOC=C
InChIInChI=1S/C7H12O/c1-3-5-6-7-8-4-2/h3-4H,1-2,5-7H2
InChIKeyVFOONMUUZUQJEU-UHFFFAOYSA-N
XLogP2.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.17
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,4-dihydro-2H-pyran
CID 8080
cis-1-Butenyl ethyl ether
CID 5364930
(E)-1-Methoxy-1-butene
CID 5366228
1-Ethoxybut-1-ene
CID 138375
1-Butene, 1-methoxy-
CID 94402
cis-1-Methoxy-1-butene
CID 5366227
6-Methoxy-1-hexene
CID 542269
1-Pentene, 5-methoxy-
CID 542338
4,5-Dihydrooxepine
CID 637996
(1Z)-1-ethoxybut-1-ene
CID 5364929
2,3,4,5-Tetrahydrooxepine
CID 11309477
(z)-1-Ethoxy-1,5-hexadiene
CID 11126266

Frequently Asked Questions

What is the IUPAC name of 5-ethenoxypent-1-ene?
The IUPAC name of 5-ethenoxypent-1-ene (CID 13130298) is 5-ethenoxypent-1-ene.
What is the SMILES notation for 5-ethenoxypent-1-ene?
The canonical SMILES for 5-ethenoxypent-1-ene is C=CCCCOC=C.
What is the InChIKey of 5-ethenoxypent-1-ene?
The InChIKey is VFOONMUUZUQJEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O/c1-3-5-6-7-8-4-2/h3-4H,1-2,5-7H2.
What are the key properties of 5-ethenoxypent-1-ene?
5-ethenoxypent-1-ene has a molecular weight of 112.17 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenoxypent-1-ene is sourced from PubChem (CID 13130298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).