CID 173046303

C13H19HfSi-3 — CID 173046303

IUPAC—
SMILESC[Si]C.[CH3-].[CH3-].[Hf].c1ccc2[cH-]ccc2c1
InChIInChI=1S/C9H7.C2H6Si.2CH3.Hf/c1-2-5-9-7-3-6-8(9)4-1;1-3-2;;;/h1-7H;1-2H3;2*1H3;/q-1;;2*-1;
InChIKeyOMVFRHWSAHYQJY-UHFFFAOYSA-N
MW381.87 g/mol
LogP4.24
Rot. Bonds

About CID 173046303

CID 173046303 (PubChem CID 173046303) has the molecular formula C13H19HfSi-3 and a molecular weight of 381.87 g/mol.

Molecular Properties

Compound NameCID 173046303
PubChem CID173046303
Molecular FormulaC13H19HfSi-3
Molecular Weight381.87 g/mol
Exact Mass383.07
IUPAC Name—
SMILESC[Si]C.[CH3-].[CH3-].[Hf].c1ccc2[cH-]ccc2c1
InChIInChI=1S/C9H7.C2H6Si.2CH3.Hf/c1-2-5-9-7-3-6-8(9)4-1;1-3-2;;;/h1-7H;1-2H3;2*1H3;/q-1;;2*-1;
InChIKeyOMVFRHWSAHYQJY-UHFFFAOYSA-N
XLogP4.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.87
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 173046303 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 173020182
CID 173020182
CID 173237181
CID 173237181
CID 173188093
CID 173188093
carbanide;1H-inden-1-ide;titanium(3+);trichloride
CID 157275442
CID 173266360
CID 173266360
carbanide;dimethylsilylidenetitanium;bis(1H-inden-1-ide)
CID 173073512
dibromozirconium;1H-inden-1-ide
CID 173211982
1H-inden-1-ide;titanium(3+);difluoride
CID 87792956
1H-inden-1-ide;titanium;dihydrochloride
CID 87738152
1H-inden-1-ide;zirconium(4+);trichloride
CID 71421360
magnesium;1H-inden-1-ide;bromide
CID 12823996
ethanolate;hafnium;1H-inden-1-ide
CID 159970065

Frequently Asked Questions

What is the IUPAC name of CID 173046303?
The IUPAC name of CID 173046303 (CID 173046303) is not available.
What is the SMILES notation for CID 173046303?
The canonical SMILES for CID 173046303 is C[Si]C.[CH3-].[CH3-].[Hf].c1ccc2[cH-]ccc2c1.
What is the InChIKey of CID 173046303?
The InChIKey is OMVFRHWSAHYQJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7.C2H6Si.2CH3.Hf/c1-2-5-9-7-3-6-8(9)4-1;1-3-2;;;/h1-7H;1-2H3;2*1H3;/q-1;;2*-1;.
What are the key properties of CID 173046303?
CID 173046303 has a molecular weight of 381.87 g/mol, XLogP of 4.24, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173046303 is sourced from PubChem (CID 173046303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).