3-chloro-9H-fluorene

C13H9Cl — CID 19800356

IUPAC3-chloro-9H-fluorene
SMILESClc1ccc2c(c1)-c1ccccc1C2
InChIInChI=1S/C13H9Cl/c14-11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-6,8H,7H2
InChIKeyIKCMKJPFGUEKHR-UHFFFAOYSA-N
MW200.67 g/mol
LogP3.91
Rot. Bonds

About 3-chloro-9H-fluorene

3-chloro-9H-fluorene (PubChem CID 19800356) has the molecular formula C13H9Cl and a molecular weight of 200.67 g/mol. Its IUPAC name is 3-chloro-9H-fluorene.

Molecular Properties

Compound Name3-chloro-9H-fluorene
PubChem CID19800356
Molecular FormulaC13H9Cl
Molecular Weight200.67 g/mol
Exact Mass200.04
IUPAC Name3-chloro-9H-fluorene
SMILESClc1ccc2c(c1)-c1ccccc1C2
InChIInChI=1S/C13H9Cl/c14-11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-6,8H,7H2
InChIKeyIKCMKJPFGUEKHR-UHFFFAOYSA-N
XLogP3.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.67
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-9H-fluorene?
The IUPAC name of 3-chloro-9H-fluorene (CID 19800356) is 3-chloro-9H-fluorene.
What is the SMILES notation for 3-chloro-9H-fluorene?
The canonical SMILES for 3-chloro-9H-fluorene is Clc1ccc2c(c1)-c1ccccc1C2.
What is the InChIKey of 3-chloro-9H-fluorene?
The InChIKey is IKCMKJPFGUEKHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl/c14-11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-6,8H,7H2.
What are the key properties of 3-chloro-9H-fluorene?
3-chloro-9H-fluorene has a molecular weight of 200.67 g/mol, XLogP of 3.91, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-9H-fluorene is sourced from PubChem (CID 19800356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).