4-but-3-enoxybut-1-ene

C8H14O — CID 15273984

IUPAC4-but-3-enoxybut-1-ene
SMILESC=CCCOCCC=C
InChIInChI=1S/C8H14O/c1-3-5-7-9-8-6-4-2/h3-4H,1-2,5-8H2
InChIKeyYXZMHODJXOQERH-UHFFFAOYSA-N
MW126.20 g/mol
LogP2.16
Rot. Bonds6

About 4-but-3-enoxybut-1-ene

4-but-3-enoxybut-1-ene (PubChem CID 15273984) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 4-but-3-enoxybut-1-ene.

Molecular Properties

Compound Name4-but-3-enoxybut-1-ene
PubChem CID15273984
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name4-but-3-enoxybut-1-ene
SMILESC=CCCOCCC=C
InChIInChI=1S/C8H14O/c1-3-5-7-9-8-6-4-2/h3-4H,1-2,5-8H2
InChIKeyYXZMHODJXOQERH-UHFFFAOYSA-N
XLogP2.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 52.16
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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Related Compounds

4-Methoxybut-1-ene
CID 317680
4-Ethoxybut-1-ene
CID 533994
3-Butenyl n-butyl ether
CID 545109
3-Oxa-1,6-heptadiene
CID 12820525
5-(Pent-4-en-1-yloxy)pent-1-ene
CID 19612338
3-Fluoro-4-(2-fluorobut-3-enoxy)but-1-ene
CID 152233004
4-(2-Fluoroethoxy)but-1-ene
CID 159544536
5-But-3-enoxy-5-fluoropent-1-ene
CID 165382534
4-(Fluoromethoxy)but-1-ene
CID 176847525
Ether, 3-butenyl propyl
CID 536090
4-Prop-2-ynoxybut-1-ene
CID 10931389
4-Prop-1-en-2-yloxybut-1-ene
CID 135043193

Frequently Asked Questions

What is the IUPAC name of 4-but-3-enoxybut-1-ene?
The IUPAC name of 4-but-3-enoxybut-1-ene (CID 15273984) is 4-but-3-enoxybut-1-ene.
What is the SMILES notation for 4-but-3-enoxybut-1-ene?
The canonical SMILES for 4-but-3-enoxybut-1-ene is C=CCCOCCC=C.
What is the InChIKey of 4-but-3-enoxybut-1-ene?
The InChIKey is YXZMHODJXOQERH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-3-5-7-9-8-6-4-2/h3-4H,1-2,5-8H2.
What are the key properties of 4-but-3-enoxybut-1-ene?
4-but-3-enoxybut-1-ene has a molecular weight of 126.20 g/mol, XLogP of 2.16, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-but-3-enoxybut-1-ene is sourced from PubChem (CID 15273984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).