4,5-difluoro-9H-fluoren-9-amine

C13H9F2N — CID 82578575

IUPAC4,5-difluoro-9H-fluoren-9-amine
SMILESNC1c2cccc(F)c2-c2c(F)cccc21
InChIInChI=1S/C13H9F2N/c14-9-5-1-3-7-11(9)12-8(13(7)16)4-2-6-10(12)15/h1-6,13H,16H2
InChIKeyBRPBVTLDFVMASP-UHFFFAOYSA-N
MW217.22 g/mol
LogP2.99
Rot. Bonds

About 4,5-difluoro-9H-fluoren-9-amine

4,5-difluoro-9H-fluoren-9-amine (PubChem CID 82578575) has the molecular formula C13H9F2N and a molecular weight of 217.22 g/mol. Its IUPAC name is 4,5-difluoro-9H-fluoren-9-amine.

Molecular Properties

Compound Name4,5-difluoro-9H-fluoren-9-amine
PubChem CID82578575
Molecular FormulaC13H9F2N
Molecular Weight217.22 g/mol
Exact Mass217.07
IUPAC Name4,5-difluoro-9H-fluoren-9-amine
SMILESNC1c2cccc(F)c2-c2c(F)cccc21
InChIInChI=1S/C13H9F2N/c14-9-5-1-3-7-11(9)12-8(13(7)16)4-2-6-10(12)15/h1-6,13H,16H2
InChIKeyBRPBVTLDFVMASP-UHFFFAOYSA-N
XLogP2.99
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.22
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,5-difluoro-9H-fluoren-9-amine?
The IUPAC name of 4,5-difluoro-9H-fluoren-9-amine (CID 82578575) is 4,5-difluoro-9H-fluoren-9-amine.
What is the SMILES notation for 4,5-difluoro-9H-fluoren-9-amine?
The canonical SMILES for 4,5-difluoro-9H-fluoren-9-amine is NC1c2cccc(F)c2-c2c(F)cccc21.
What is the InChIKey of 4,5-difluoro-9H-fluoren-9-amine?
The InChIKey is BRPBVTLDFVMASP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F2N/c14-9-5-1-3-7-11(9)12-8(13(7)16)4-2-6-10(12)15/h1-6,13H,16H2.
What are the key properties of 4,5-difluoro-9H-fluoren-9-amine?
4,5-difluoro-9H-fluoren-9-amine has a molecular weight of 217.22 g/mol, XLogP of 2.99, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-difluoro-9H-fluoren-9-amine is sourced from PubChem (CID 82578575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).