1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine

C6H4F4N2 — CID 18365815

IUPAC1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine
SMILESFN(F)c1ccccc1N(F)F
InChIInChI=1S/C6H4F4N2/c7-11(8)5-3-1-2-4-6(5)12(9)10/h1-4H
InChIKeyDCTFCVYVHBHICU-UHFFFAOYSA-N
MW180.10 g/mol
LogP2.84
Rot. Bonds2

About 1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine

1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine (PubChem CID 18365815) has the molecular formula C6H4F4N2 and a molecular weight of 180.10 g/mol. Its IUPAC name is 1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine.

Molecular Properties

Compound Name1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine
PubChem CID18365815
Molecular FormulaC6H4F4N2
Molecular Weight180.10 g/mol
Exact Mass180.03
IUPAC Name1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine
SMILESFN(F)c1ccccc1N(F)F
InChIInChI=1S/C6H4F4N2/c7-11(8)5-3-1-2-4-6(5)12(9)10/h1-4H
InChIKeyDCTFCVYVHBHICU-UHFFFAOYSA-N
XLogP2.84
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.10
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine?
The IUPAC name of 1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine (CID 18365815) is 1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine.
What is the SMILES notation for 1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine?
The canonical SMILES for 1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine is FN(F)c1ccccc1N(F)F.
What is the InChIKey of 1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine?
The InChIKey is DCTFCVYVHBHICU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F4N2/c7-11(8)5-3-1-2-4-6(5)12(9)10/h1-4H.
What are the key properties of 1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine?
1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine has a molecular weight of 180.10 g/mol, XLogP of 2.84, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,2-N,2-N-tetrafluorobenzene-1,2-diamine is sourced from PubChem (CID 18365815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).