9-methylidenefluorene-1,2-dicarbonitrile

C16H8N2 — CID 18692894

IUPAC9-methylidenefluorene-1,2-dicarbonitrile
SMILESC=C1c2ccccc2-c2ccc(C#N)c(C#N)c21
InChIInChI=1S/C16H8N2/c1-10-12-4-2-3-5-13(12)14-7-6-11(8-17)15(9-18)16(10)14/h2-7H,1H2
InChIKeyGIGXBPGLZBOOJT-UHFFFAOYSA-N
MW228.25 g/mol
LogP3.47
Rot. Bonds

About 9-methylidenefluorene-1,2-dicarbonitrile

9-methylidenefluorene-1,2-dicarbonitrile (PubChem CID 18692894) has the molecular formula C16H8N2 and a molecular weight of 228.25 g/mol. Its IUPAC name is 9-methylidenefluorene-1,2-dicarbonitrile.

Molecular Properties

Compound Name9-methylidenefluorene-1,2-dicarbonitrile
PubChem CID18692894
Molecular FormulaC16H8N2
Molecular Weight228.25 g/mol
Exact Mass228.07
IUPAC Name9-methylidenefluorene-1,2-dicarbonitrile
SMILESC=C1c2ccccc2-c2ccc(C#N)c(C#N)c21
InChIInChI=1S/C16H8N2/c1-10-12-4-2-3-5-13(12)14-7-6-11(8-17)15(9-18)16(10)14/h2-7H,1H2
InChIKeyGIGXBPGLZBOOJT-UHFFFAOYSA-N
XLogP3.47
TPSA47.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-methylidenefluorene-1,2-dicarbonitrile?
The IUPAC name of 9-methylidenefluorene-1,2-dicarbonitrile (CID 18692894) is 9-methylidenefluorene-1,2-dicarbonitrile.
What is the SMILES notation for 9-methylidenefluorene-1,2-dicarbonitrile?
The canonical SMILES for 9-methylidenefluorene-1,2-dicarbonitrile is C=C1c2ccccc2-c2ccc(C#N)c(C#N)c21.
What is the InChIKey of 9-methylidenefluorene-1,2-dicarbonitrile?
The InChIKey is GIGXBPGLZBOOJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H8N2/c1-10-12-4-2-3-5-13(12)14-7-6-11(8-17)15(9-18)16(10)14/h2-7H,1H2.
What are the key properties of 9-methylidenefluorene-1,2-dicarbonitrile?
9-methylidenefluorene-1,2-dicarbonitrile has a molecular weight of 228.25 g/mol, XLogP of 3.47, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methylidenefluorene-1,2-dicarbonitrile is sourced from PubChem (CID 18692894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).