2-[(E)-pent-2-enoxy]ethanol

C7H14O2 — CID 130122499

IUPAC2-[(E)-pent-2-enoxy]ethanol
SMILESCC/C=C/COCCO
InChIInChI=1S/C7H14O2/c1-2-3-4-6-9-7-5-8/h3-4,8H,2,5-7H2,1H3/b4-3+
InChIKeyNOIWSRVOTGUGGJ-ONEGZZNKSA-N
MW130.19 g/mol
LogP0.96
Rot. Bonds5

About 2-[(E)-pent-2-enoxy]ethanol

2-[(E)-pent-2-enoxy]ethanol (PubChem CID 130122499) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is 2-[(E)-pent-2-enoxy]ethanol.

Molecular Properties

Compound Name2-[(E)-pent-2-enoxy]ethanol
PubChem CID130122499
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name2-[(E)-pent-2-enoxy]ethanol
SMILESCC/C=C/COCCO
InChIInChI=1S/C7H14O2/c1-2-3-4-6-9-7-5-8/h3-4,8H,2,5-7H2,1H3/b4-3+
InChIKeyNOIWSRVOTGUGGJ-ONEGZZNKSA-N
XLogP0.96
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

2-[2-(2-but-1-enoxyethoxy)ethoxy]ethanol
CID 140501157
2-ethoxyethanol;1-hydroperoxybut-1-ene
CID 173460043
2-penta-2,4-dienoxyethanol
CID 141172207
2-[2-[2-[2-(2-octa-2,7-dienoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
CID 87170296
(Z)-4-dodecoxybut-2-en-1-ol
CID 6912104
1-methoxypent-2-ene
CID 551185
2-ethoxyethanol;neodymium
CID 174490221
2-ethoxyethanol;silane
CID 173283937
2-[2-[2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619770
2-[2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619769
2-[6-(4-ethylphenoxy)hexa-2,4-dienoxy]ethanol
CID 141387799
4-[(E)-pent-2-enoxy]-1-pyrrolidin-1-ylbutan-1-one
CID 45276220

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-pent-2-enoxy]ethanol?
The IUPAC name of 2-[(E)-pent-2-enoxy]ethanol (CID 130122499) is 2-[(E)-pent-2-enoxy]ethanol.
What is the SMILES notation for 2-[(E)-pent-2-enoxy]ethanol?
The canonical SMILES for 2-[(E)-pent-2-enoxy]ethanol is CC/C=C/COCCO.
What is the InChIKey of 2-[(E)-pent-2-enoxy]ethanol?
The InChIKey is NOIWSRVOTGUGGJ-ONEGZZNKSA-N. The full InChI is InChI=1S/C7H14O2/c1-2-3-4-6-9-7-5-8/h3-4,8H,2,5-7H2,1H3/b4-3+.
What are the key properties of 2-[(E)-pent-2-enoxy]ethanol?
2-[(E)-pent-2-enoxy]ethanol has a molecular weight of 130.19 g/mol, XLogP of 0.96, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-pent-2-enoxy]ethanol is sourced from PubChem (CID 130122499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).