2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde

C8H10O2 — CID 10606803

IUPAC2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde
SMILESC=C(C)C1CC(C=O)=CO1
InChIInChI=1S/C8H10O2/c1-6(2)8-3-7(4-9)5-10-8/h4-5,8H,1,3H2,2H3
InChIKeyOHURMDRQNGOUSR-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.43
Rot. Bonds2

About 2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde

2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde (PubChem CID 10606803) has the molecular formula C8H10O2 and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde.

Molecular Properties

Compound Name2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde
PubChem CID10606803
Molecular FormulaC8H10O2
Molecular Weight138.17 g/mol
Exact Mass138.07
IUPAC Name2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde
SMILESC=C(C)C1CC(C=O)=CO1
InChIInChI=1S/C8H10O2/c1-6(2)8-3-7(4-9)5-10-8/h4-5,8H,1,3H2,2H3
InChIKeyOHURMDRQNGOUSR-UHFFFAOYSA-N
XLogP1.43
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde?
The IUPAC name of 2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde (CID 10606803) is 2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde.
What is the SMILES notation for 2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde?
The canonical SMILES for 2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde is C=C(C)C1CC(C=O)=CO1.
What is the InChIKey of 2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde?
The InChIKey is OHURMDRQNGOUSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2/c1-6(2)8-3-7(4-9)5-10-8/h4-5,8H,1,3H2,2H3.
What are the key properties of 2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde?
2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde has a molecular weight of 138.17 g/mol, XLogP of 1.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-1-en-2-yl-2,3-dihydrofuran-4-carbaldehyde is sourced from PubChem (CID 10606803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).