1-anilinoethylidenechromium

C8H9CrN — CID 519989

IUPAC1-anilinoethylidenechromium
SMILESCC(=[Cr])Nc1ccccc1
InChIInChI=1S/C8H9N.Cr/c1-2-9-8-6-4-3-5-7-8;/h3-7,9H,1H3;
InChIKeyUSWJZHZWNLECTA-UHFFFAOYSA-N
MW171.16 g/mol
LogP1.80
Rot. Bonds2

About 1-anilinoethylidenechromium

1-anilinoethylidenechromium (PubChem CID 519989) has the molecular formula C8H9CrN and a molecular weight of 171.16 g/mol. Its IUPAC name is 1-anilinoethylidenechromium.

Molecular Properties

Compound Name1-anilinoethylidenechromium
PubChem CID519989
Molecular FormulaC8H9CrN
Molecular Weight171.16 g/mol
Exact Mass171.01
IUPAC Name1-anilinoethylidenechromium
SMILESCC(=[Cr])Nc1ccccc1
InChIInChI=1S/C8H9N.Cr/c1-2-9-8-6-4-3-5-7-8;/h3-7,9H,1H3;
InChIKeyUSWJZHZWNLECTA-UHFFFAOYSA-N
XLogP1.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.16
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-anilinoethylidenechromium?
The IUPAC name of 1-anilinoethylidenechromium (CID 519989) is 1-anilinoethylidenechromium.
What is the SMILES notation for 1-anilinoethylidenechromium?
The canonical SMILES for 1-anilinoethylidenechromium is CC(=[Cr])Nc1ccccc1.
What is the InChIKey of 1-anilinoethylidenechromium?
The InChIKey is USWJZHZWNLECTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N.Cr/c1-2-9-8-6-4-3-5-7-8;/h3-7,9H,1H3;.
What are the key properties of 1-anilinoethylidenechromium?
1-anilinoethylidenechromium has a molecular weight of 171.16 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-anilinoethylidenechromium is sourced from PubChem (CID 519989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).