3,5-dimethylpyrazol-1-ide;trioxochromium

C5H7CrN2O3- — CID 88827968

IUPAC3,5-dimethylpyrazol-1-ide;trioxochromium
SMILESCc1cc(C)[n-]n1.O=[Cr](=O)=O
InChIInChI=1S/C5H7N2.Cr.3O/c1-4-3-5(2)7-6-4;;;;/h3H,1-2H3;;;;/q-1;;;;
InChIKeyQTWARCKFEXYNSM-UHFFFAOYSA-N
MW195.12 g/mol
LogP0.30
Rot. Bonds

About 3,5-dimethylpyrazol-1-ide;trioxochromium

3,5-dimethylpyrazol-1-ide;trioxochromium (PubChem CID 88827968) has the molecular formula C5H7CrN2O3- and a molecular weight of 195.12 g/mol. Its IUPAC name is 3,5-dimethylpyrazol-1-ide;trioxochromium.

Molecular Properties

Compound Name3,5-dimethylpyrazol-1-ide;trioxochromium
PubChem CID88827968
Molecular FormulaC5H7CrN2O3-
Molecular Weight195.12 g/mol
Exact Mass194.99
IUPAC Name3,5-dimethylpyrazol-1-ide;trioxochromium
SMILESCc1cc(C)[n-]n1.O=[Cr](=O)=O
InChIInChI=1S/C5H7N2.Cr.3O/c1-4-3-5(2)7-6-4;;;;/h3H,1-2H3;;;;/q-1;;;;
InChIKeyQTWARCKFEXYNSM-UHFFFAOYSA-N
XLogP0.30
TPSA78.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.12
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethylpyrazol-1-ide;trioxochromium?
The IUPAC name of 3,5-dimethylpyrazol-1-ide;trioxochromium (CID 88827968) is 3,5-dimethylpyrazol-1-ide;trioxochromium.
What is the SMILES notation for 3,5-dimethylpyrazol-1-ide;trioxochromium?
The canonical SMILES for 3,5-dimethylpyrazol-1-ide;trioxochromium is Cc1cc(C)[n-]n1.O=[Cr](=O)=O.
What is the InChIKey of 3,5-dimethylpyrazol-1-ide;trioxochromium?
The InChIKey is QTWARCKFEXYNSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N2.Cr.3O/c1-4-3-5(2)7-6-4;;;;/h3H,1-2H3;;;;/q-1;;;;.
What are the key properties of 3,5-dimethylpyrazol-1-ide;trioxochromium?
3,5-dimethylpyrazol-1-ide;trioxochromium has a molecular weight of 195.12 g/mol, XLogP of 0.30, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethylpyrazol-1-ide;trioxochromium is sourced from PubChem (CID 88827968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).