CID 22311255

C20H20Cl2GeZr — CID 22311255

IUPAC—
SMILESC[Ge]C.[Cl-].[Cl-].[Zr+4].c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1
InChIInChI=1S/2C9H7.C2H6Ge.2ClH.Zr/c2*1-2-5-9-7-3-6-8(9)4-1;1-3-2;;;/h2*1-7H;1-2H3;2*1H;/q2*-1;;;;+4/p-2
InChIKeyOQHSSJIKSTWZPE-UHFFFAOYSA-L
MW495.12 g/mol
LogP-0.09
Rot. Bonds

About CID 22311255

CID 22311255 (PubChem CID 22311255) has the molecular formula C20H20Cl2GeZr and a molecular weight of 495.12 g/mol.

Molecular Properties

Compound NameCID 22311255
PubChem CID22311255
Molecular FormulaC20H20Cl2GeZr
Molecular Weight495.12 g/mol
Exact Mass493.92
IUPAC Name—
SMILESC[Ge]C.[Cl-].[Cl-].[Zr+4].c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1
InChIInChI=1S/2C9H7.C2H6Ge.2ClH.Zr/c2*1-2-5-9-7-3-6-8(9)4-1;1-3-2;;;/h2*1-7H;1-2H3;2*1H;/q2*-1;;;;+4/p-2
InChIKeyOQHSSJIKSTWZPE-UHFFFAOYSA-L
XLogP-0.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500495.12
LogP ≤ 5-0.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 22311255?
The IUPAC name of CID 22311255 (CID 22311255) is not available.
What is the SMILES notation for CID 22311255?
The canonical SMILES for CID 22311255 is C[Ge]C.[Cl-].[Cl-].[Zr+4].c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1.
What is the InChIKey of CID 22311255?
The InChIKey is OQHSSJIKSTWZPE-UHFFFAOYSA-L. The full InChI is InChI=1S/2C9H7.C2H6Ge.2ClH.Zr/c2*1-2-5-9-7-3-6-8(9)4-1;1-3-2;;;/h2*1-7H;1-2H3;2*1H;/q2*-1;;;;+4/p-2.
What are the key properties of CID 22311255?
CID 22311255 has a molecular weight of 495.12 g/mol, XLogP of -0.09, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22311255 is sourced from PubChem (CID 22311255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).