2-(4-fluorophenyl)-4-methyl-4H-chromene

C16H13FO — CID 70356330

IUPAC2-(4-fluorophenyl)-4-methyl-4H-chromene
SMILESCC1C=C(c2ccc(F)cc2)Oc2ccccc21
InChIInChI=1S/C16H13FO/c1-11-10-16(12-6-8-13(17)9-7-12)18-15-5-3-2-4-14(11)15/h2-11H,1H3
InChIKeyMVNFIOBJJVUDSJ-UHFFFAOYSA-N
MW240.28 g/mol
LogP4.36
Rot. Bonds1

About 2-(4-fluorophenyl)-4-methyl-4H-chromene

2-(4-fluorophenyl)-4-methyl-4H-chromene (PubChem CID 70356330) has the molecular formula C16H13FO and a molecular weight of 240.28 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-4-methyl-4H-chromene.

Molecular Properties

Compound Name2-(4-fluorophenyl)-4-methyl-4H-chromene
PubChem CID70356330
Molecular FormulaC16H13FO
Molecular Weight240.28 g/mol
Exact Mass240.10
IUPAC Name2-(4-fluorophenyl)-4-methyl-4H-chromene
SMILESCC1C=C(c2ccc(F)cc2)Oc2ccccc21
InChIInChI=1S/C16H13FO/c1-11-10-16(12-6-8-13(17)9-7-12)18-15-5-3-2-4-14(11)15/h2-11H,1H3
InChIKeyMVNFIOBJJVUDSJ-UHFFFAOYSA-N
XLogP4.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.28
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-4-methyl-4H-chromene?
The IUPAC name of 2-(4-fluorophenyl)-4-methyl-4H-chromene (CID 70356330) is 2-(4-fluorophenyl)-4-methyl-4H-chromene.
What is the SMILES notation for 2-(4-fluorophenyl)-4-methyl-4H-chromene?
The canonical SMILES for 2-(4-fluorophenyl)-4-methyl-4H-chromene is CC1C=C(c2ccc(F)cc2)Oc2ccccc21.
What is the InChIKey of 2-(4-fluorophenyl)-4-methyl-4H-chromene?
The InChIKey is MVNFIOBJJVUDSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FO/c1-11-10-16(12-6-8-13(17)9-7-12)18-15-5-3-2-4-14(11)15/h2-11H,1H3.
What are the key properties of 2-(4-fluorophenyl)-4-methyl-4H-chromene?
2-(4-fluorophenyl)-4-methyl-4H-chromene has a molecular weight of 240.28 g/mol, XLogP of 4.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-4-methyl-4H-chromene is sourced from PubChem (CID 70356330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).