7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene

C15H12ClFO — CID 144986862

IUPAC7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene
SMILESFc1cccc(-c2ccc3c(c2)OCCC3)c1Cl
InChIInChI=1S/C15H12ClFO/c16-15-12(4-1-5-13(15)17)11-7-6-10-3-2-8-18-14(10)9-11/h1,4-7,9H,2-3,8H2
InChIKeyVVDUEYCNPPWAAZ-UHFFFAOYSA-N
MW262.71 g/mol
LogP4.47
Rot. Bonds1

About 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene

7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene (PubChem CID 144986862) has the molecular formula C15H12ClFO and a molecular weight of 262.71 g/mol. Its IUPAC name is 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene
PubChem CID144986862
Molecular FormulaC15H12ClFO
Molecular Weight262.71 g/mol
Exact Mass262.06
IUPAC Name7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene
SMILESFc1cccc(-c2ccc3c(c2)OCCC3)c1Cl
InChIInChI=1S/C15H12ClFO/c16-15-12(4-1-5-13(15)17)11-7-6-10-3-2-8-18-14(10)9-11/h1,4-7,9H,2-3,8H2
InChIKeyVVDUEYCNPPWAAZ-UHFFFAOYSA-N
XLogP4.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.71
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene?
The IUPAC name of 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene (CID 144986862) is 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene.
What is the SMILES notation for 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene?
The canonical SMILES for 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene is Fc1cccc(-c2ccc3c(c2)OCCC3)c1Cl.
What is the InChIKey of 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene?
The InChIKey is VVDUEYCNPPWAAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFO/c16-15-12(4-1-5-13(15)17)11-7-6-10-3-2-8-18-14(10)9-11/h1,4-7,9H,2-3,8H2.
What are the key properties of 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene?
7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene has a molecular weight of 262.71 g/mol, XLogP of 4.47, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-chloro-3-fluorophenyl)-3,4-dihydro-2H-chromene is sourced from PubChem (CID 144986862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).