9-(dichloromethyl)-3,6-difluoro-9H-fluorene

C14H8Cl2F2 — CID 611907

IUPAC9-(dichloromethyl)-3,6-difluoro-9H-fluorene
SMILESFc1ccc2c(c1)-c1cc(F)ccc1C2C(Cl)Cl
InChIInChI=1S/C14H8Cl2F2/c15-14(16)13-9-3-1-7(17)5-11(9)12-6-8(18)2-4-10(12)13/h1-6,13-14H
InChIKeyZILSNTAKAOHGEZ-UHFFFAOYSA-N
MW285.12 g/mol
LogP4.88
Rot. Bonds1

About 9-(dichloromethyl)-3,6-difluoro-9H-fluorene

9-(dichloromethyl)-3,6-difluoro-9H-fluorene (PubChem CID 611907) has the molecular formula C14H8Cl2F2 and a molecular weight of 285.12 g/mol. Its IUPAC name is 9-(dichloromethyl)-3,6-difluoro-9H-fluorene.

Molecular Properties

Compound Name9-(dichloromethyl)-3,6-difluoro-9H-fluorene
PubChem CID611907
Molecular FormulaC14H8Cl2F2
Molecular Weight285.12 g/mol
Exact Mass284.00
IUPAC Name9-(dichloromethyl)-3,6-difluoro-9H-fluorene
SMILESFc1ccc2c(c1)-c1cc(F)ccc1C2C(Cl)Cl
InChIInChI=1S/C14H8Cl2F2/c15-14(16)13-9-3-1-7(17)5-11(9)12-6-8(18)2-4-10(12)13/h1-6,13-14H
InChIKeyZILSNTAKAOHGEZ-UHFFFAOYSA-N
XLogP4.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.12
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 9-(dichloromethyl)-3,6-difluoro-9H-fluorene 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 9-(dichloromethyl)-3,6-difluoro-9H-fluorene?
The IUPAC name of 9-(dichloromethyl)-3,6-difluoro-9H-fluorene (CID 611907) is 9-(dichloromethyl)-3,6-difluoro-9H-fluorene.
What is the SMILES notation for 9-(dichloromethyl)-3,6-difluoro-9H-fluorene?
The canonical SMILES for 9-(dichloromethyl)-3,6-difluoro-9H-fluorene is Fc1ccc2c(c1)-c1cc(F)ccc1C2C(Cl)Cl.
What is the InChIKey of 9-(dichloromethyl)-3,6-difluoro-9H-fluorene?
The InChIKey is ZILSNTAKAOHGEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2F2/c15-14(16)13-9-3-1-7(17)5-11(9)12-6-8(18)2-4-10(12)13/h1-6,13-14H.
What are the key properties of 9-(dichloromethyl)-3,6-difluoro-9H-fluorene?
9-(dichloromethyl)-3,6-difluoro-9H-fluorene has a molecular weight of 285.12 g/mol, XLogP of 4.88, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(dichloromethyl)-3,6-difluoro-9H-fluorene is sourced from PubChem (CID 611907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).