4-fluoro-6,7-dihydro-5H-chromene

C9H9FO — CID 174531903

IUPAC4-fluoro-6,7-dihydro-5H-chromene
SMILESFC1=C2CCCC=C2OC=C1
InChIInChI=1S/C9H9FO/c10-8-5-6-11-9-4-2-1-3-7(8)9/h4-6H,1-3H2
InChIKeyJDDNEQUFMPWHQH-UHFFFAOYSA-N
MW152.17 g/mol
LogP2.82
Rot. Bonds

About 4-fluoro-6,7-dihydro-5H-chromene

4-fluoro-6,7-dihydro-5H-chromene (PubChem CID 174531903) has the molecular formula C9H9FO and a molecular weight of 152.17 g/mol. Its IUPAC name is 4-fluoro-6,7-dihydro-5H-chromene.

Molecular Properties

Compound Name4-fluoro-6,7-dihydro-5H-chromene
PubChem CID174531903
Molecular FormulaC9H9FO
Molecular Weight152.17 g/mol
Exact Mass152.06
IUPAC Name4-fluoro-6,7-dihydro-5H-chromene
SMILESFC1=C2CCCC=C2OC=C1
InChIInChI=1S/C9H9FO/c10-8-5-6-11-9-4-2-1-3-7(8)9/h4-6H,1-3H2
InChIKeyJDDNEQUFMPWHQH-UHFFFAOYSA-N
XLogP2.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.17
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-6,7-dihydro-5H-chromene?
The IUPAC name of 4-fluoro-6,7-dihydro-5H-chromene (CID 174531903) is 4-fluoro-6,7-dihydro-5H-chromene.
What is the SMILES notation for 4-fluoro-6,7-dihydro-5H-chromene?
The canonical SMILES for 4-fluoro-6,7-dihydro-5H-chromene is FC1=C2CCCC=C2OC=C1.
What is the InChIKey of 4-fluoro-6,7-dihydro-5H-chromene?
The InChIKey is JDDNEQUFMPWHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FO/c10-8-5-6-11-9-4-2-1-3-7(8)9/h4-6H,1-3H2.
What are the key properties of 4-fluoro-6,7-dihydro-5H-chromene?
4-fluoro-6,7-dihydro-5H-chromene has a molecular weight of 152.17 g/mol, XLogP of 2.82, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-6,7-dihydro-5H-chromene is sourced from PubChem (CID 174531903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).