3,6-dichloro-9H-fluorene-2,7-diamine

C13H10Cl2N2 — CID 67732913

IUPAC3,6-dichloro-9H-fluorene-2,7-diamine
SMILESNc1cc2c(cc1Cl)-c1cc(Cl)c(N)cc1C2
InChIInChI=1S/C13H10Cl2N2/c14-10-4-8-6(2-12(10)16)1-7-3-13(17)11(15)5-9(7)8/h2-5H,1,16-17H2
InChIKeyRUOLTOPOAKJVTO-UHFFFAOYSA-N
MW265.14 g/mol
LogP3.73
Rot. Bonds

About 3,6-dichloro-9H-fluorene-2,7-diamine

3,6-dichloro-9H-fluorene-2,7-diamine (PubChem CID 67732913) has the molecular formula C13H10Cl2N2 and a molecular weight of 265.14 g/mol. Its IUPAC name is 3,6-dichloro-9H-fluorene-2,7-diamine.

Molecular Properties

Compound Name3,6-dichloro-9H-fluorene-2,7-diamine
PubChem CID67732913
Molecular FormulaC13H10Cl2N2
Molecular Weight265.14 g/mol
Exact Mass264.02
IUPAC Name3,6-dichloro-9H-fluorene-2,7-diamine
SMILESNc1cc2c(cc1Cl)-c1cc(Cl)c(N)cc1C2
InChIInChI=1S/C13H10Cl2N2/c14-10-4-8-6(2-12(10)16)1-7-3-13(17)11(15)5-9(7)8/h2-5H,1,16-17H2
InChIKeyRUOLTOPOAKJVTO-UHFFFAOYSA-N
XLogP3.73
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.14
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-9H-fluorene-2,7-diamine?
The IUPAC name of 3,6-dichloro-9H-fluorene-2,7-diamine (CID 67732913) is 3,6-dichloro-9H-fluorene-2,7-diamine.
What is the SMILES notation for 3,6-dichloro-9H-fluorene-2,7-diamine?
The canonical SMILES for 3,6-dichloro-9H-fluorene-2,7-diamine is Nc1cc2c(cc1Cl)-c1cc(Cl)c(N)cc1C2.
What is the InChIKey of 3,6-dichloro-9H-fluorene-2,7-diamine?
The InChIKey is RUOLTOPOAKJVTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2/c14-10-4-8-6(2-12(10)16)1-7-3-13(17)11(15)5-9(7)8/h2-5H,1,16-17H2.
What are the key properties of 3,6-dichloro-9H-fluorene-2,7-diamine?
3,6-dichloro-9H-fluorene-2,7-diamine has a molecular weight of 265.14 g/mol, XLogP of 3.73, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-9H-fluorene-2,7-diamine is sourced from PubChem (CID 67732913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).