1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene

C15H22O2 — CID 139905492

IUPAC1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene
SMILESC=C(CCC)c1ccccc1OCCOCC
InChIInChI=1S/C15H22O2/c1-4-8-13(3)14-9-6-7-10-15(14)17-12-11-16-5-2/h6-7,9-10H,3-5,8,11-12H2,1-2H3
InChIKeyCDIWWZKAIYPRQV-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.92
Rot. Bonds8

About 1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene

1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene (PubChem CID 139905492) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene.

Molecular Properties

Compound Name1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene
PubChem CID139905492
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene
SMILESC=C(CCC)c1ccccc1OCCOCC
InChIInChI=1S/C15H22O2/c1-4-8-13(3)14-9-6-7-10-15(14)17-12-11-16-5-2/h6-7,9-10H,3-5,8,11-12H2,1-2H3
InChIKeyCDIWWZKAIYPRQV-UHFFFAOYSA-N
XLogP3.92
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-ethoxyethoxy)-2-methoxybenzene
CID 57249631
[2-(2-ethoxyethoxy)phenyl]-trifluoroboranuide
CID 63676800
potassium [2-(2-ethoxyethoxy)phenyl]-trifluoroboranuide
CID 63676799
2-(2-propoxyethoxy)benzenecarboximidamide
CID 63684381
(2S)-2-[[2-(2-ethoxyethoxy)benzoyl]amino]propanoic acid
CID 119237944
2-[2-[5-(2-ethoxyethoxy)naphthalen-1-yl]oxyethoxy]ethanol
CID 144738763
1-[2-[2-(2-butoxyethoxy)ethoxy]phenyl]ethanone
CID 43793701
1-ethyl-2-pent-1-en-2-ylbenzene
CID 173350978
2-[[2-(2-ethoxyethoxy)benzoyl]-methylamino]propanoic acid
CID 119358857
2-(2-ethoxyethoxy)-N-(2-fluorophenyl)benzamide
CID 17122747
ethyl 2-[[2-(2-ethoxyethoxy)benzoyl]-methylamino]acetate
CID 54785153
2-(2-butoxyethoxy)benzenecarbothioamide
CID 29001981

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene?
The IUPAC name of 1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene (CID 139905492) is 1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene.
What is the SMILES notation for 1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene?
The canonical SMILES for 1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene is C=C(CCC)c1ccccc1OCCOCC.
What is the InChIKey of 1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene?
The InChIKey is CDIWWZKAIYPRQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-4-8-13(3)14-9-6-7-10-15(14)17-12-11-16-5-2/h6-7,9-10H,3-5,8,11-12H2,1-2H3.
What are the key properties of 1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene?
1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene has a molecular weight of 234.34 g/mol, XLogP of 3.92, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethoxy)-2-pent-1-en-2-ylbenzene is sourced from PubChem (CID 139905492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).