2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran

C14H22O — CID 15892525

IUPAC2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran
SMILESC=CCC1=C(CC=C)C(CCCC)OC1
InChIInChI=1S/C14H22O/c1-4-7-10-14-13(9-6-3)12(8-5-2)11-15-14/h5-6,14H,2-4,7-11H2,1H3
InChIKeyWGRZFCJUSIJCMN-UHFFFAOYSA-N
MW206.33 g/mol
LogP4.02
Rot. Bonds7

About 2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran

2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran (PubChem CID 15892525) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is 2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran.

Molecular Properties

Compound Name2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran
PubChem CID15892525
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran
SMILESC=CCC1=C(CC=C)C(CCCC)OC1
InChIInChI=1S/C14H22O/c1-4-7-10-14-13(9-6-3)12(8-5-2)11-15-14/h5-6,14H,2-4,7-11H2,1H3
InChIKeyWGRZFCJUSIJCMN-UHFFFAOYSA-N
XLogP4.02
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,4,5,7a-Tetrahydro-3,6-dimethylbenzofuran
CID 21606187
2H-Pyran, 6-butyl-3,6-dihydro-2,4-dimethyl-
CID 91147
(6E,10E,14E)-3,6,10,14-tetramethyl-2,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan
CID 23425614
2H-Pyran, 2-butyl-3,6-dihydro-4,6-dimethyl-
CID 91148
(2S,5R)-2-ethenyl-2-methyl-5-[(2E)-6-methylhepta-2,5-dien-2-yl]oxolane
CID 162888684
(2S,5S)-2-ethenyl-2-methyl-5-[(2E)-6-methylhepta-2,5-dien-2-yl]oxolane
CID 162888683
(2R)-3-methyl-2-(3-methylbut-3-enyl)-2,5-dihydrofuran
CID 163015296
Tert-butyl cyclohex-2-en-1-yl ether
CID 287916
2-Butyl-4-methyl-5,6-dihydro-2H-pyran
CID 12503534
2-Butyl-4-methyl-3,6-dihydro-2h-pyran
CID 12503535
2-(2-Methylprop-1-enyl)tetrahydrofuran
CID 12735917
3-Pentyl-2,5-dihydrofuran
CID 15647309

Frequently Asked Questions

What is the IUPAC name of 2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran?
The IUPAC name of 2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran (CID 15892525) is 2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran.
What is the SMILES notation for 2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran?
The canonical SMILES for 2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran is C=CCC1=C(CC=C)C(CCCC)OC1.
What is the InChIKey of 2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran?
The InChIKey is WGRZFCJUSIJCMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O/c1-4-7-10-14-13(9-6-3)12(8-5-2)11-15-14/h5-6,14H,2-4,7-11H2,1H3.
What are the key properties of 2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran?
2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran has a molecular weight of 206.33 g/mol, XLogP of 4.02, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran is sourced from PubChem (CID 15892525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).