6,7-dihydro-5H-chromene-8-carbaldehyde

C10H10O2 — CID 174470259

IUPAC6,7-dihydro-5H-chromene-8-carbaldehyde
SMILESO=CC1=C2OC=CC=C2CCC1
InChIInChI=1S/C10H10O2/c11-7-9-4-1-3-8-5-2-6-12-10(8)9/h2,5-7H,1,3-4H2
InChIKeyOLFHYVQVEYZZED-UHFFFAOYSA-N
MW162.19 g/mol
LogP2.09
Rot. Bonds1

About 6,7-dihydro-5H-chromene-8-carbaldehyde

6,7-dihydro-5H-chromene-8-carbaldehyde (PubChem CID 174470259) has the molecular formula C10H10O2 and a molecular weight of 162.19 g/mol. Its IUPAC name is 6,7-dihydro-5H-chromene-8-carbaldehyde.

Molecular Properties

Compound Name6,7-dihydro-5H-chromene-8-carbaldehyde
PubChem CID174470259
Molecular FormulaC10H10O2
Molecular Weight162.19 g/mol
Exact Mass162.07
IUPAC Name6,7-dihydro-5H-chromene-8-carbaldehyde
SMILESO=CC1=C2OC=CC=C2CCC1
InChIInChI=1S/C10H10O2/c11-7-9-4-1-3-8-5-2-6-12-10(8)9/h2,5-7H,1,3-4H2
InChIKeyOLFHYVQVEYZZED-UHFFFAOYSA-N
XLogP2.09
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-chromene-8-carbaldehyde?
The IUPAC name of 6,7-dihydro-5H-chromene-8-carbaldehyde (CID 174470259) is 6,7-dihydro-5H-chromene-8-carbaldehyde.
What is the SMILES notation for 6,7-dihydro-5H-chromene-8-carbaldehyde?
The canonical SMILES for 6,7-dihydro-5H-chromene-8-carbaldehyde is O=CC1=C2OC=CC=C2CCC1.
What is the InChIKey of 6,7-dihydro-5H-chromene-8-carbaldehyde?
The InChIKey is OLFHYVQVEYZZED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O2/c11-7-9-4-1-3-8-5-2-6-12-10(8)9/h2,5-7H,1,3-4H2.
What are the key properties of 6,7-dihydro-5H-chromene-8-carbaldehyde?
6,7-dihydro-5H-chromene-8-carbaldehyde has a molecular weight of 162.19 g/mol, XLogP of 2.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-chromene-8-carbaldehyde is sourced from PubChem (CID 174470259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).