CID 174536512

C2H9ClSiTi — CID 174536512

IUPAC—
SMILES[CH3-].[CH3-].[Cl-].[SiH3].[Ti+3]
InChIInChI=1S/2CH3.ClH.H3Si.Ti/h2*1H3;1H;1H3;/q2*-1;;;+3/p-1
InChIKeyVLDNFMXNJMKXOD-UHFFFAOYSA-M
MW144.50 g/mol
LogP-3.28
Rot. Bonds

About CID 174536512

CID 174536512 (PubChem CID 174536512) has the molecular formula C2H9ClSiTi and a molecular weight of 144.50 g/mol.

Molecular Properties

Compound NameCID 174536512
PubChem CID174536512
Molecular FormulaC2H9ClSiTi
Molecular Weight144.50 g/mol
Exact Mass143.96
IUPAC Name—
SMILES[CH3-].[CH3-].[Cl-].[SiH3].[Ti+3]
InChIInChI=1S/2CH3.ClH.H3Si.Ti/h2*1H3;1H;1H3;/q2*-1;;;+3/p-1
InChIKeyVLDNFMXNJMKXOD-UHFFFAOYSA-M
XLogP-3.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.50
LogP ≤ 5-3.28
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'}

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Frequently Asked Questions

What is the IUPAC name of CID 174536512?
The IUPAC name of CID 174536512 (CID 174536512) is not available.
What is the SMILES notation for CID 174536512?
The canonical SMILES for CID 174536512 is [CH3-].[CH3-].[Cl-].[SiH3].[Ti+3].
What is the InChIKey of CID 174536512?
The InChIKey is VLDNFMXNJMKXOD-UHFFFAOYSA-M. The full InChI is InChI=1S/2CH3.ClH.H3Si.Ti/h2*1H3;1H;1H3;/q2*-1;;;+3/p-1.
What are the key properties of CID 174536512?
CID 174536512 has a molecular weight of 144.50 g/mol, XLogP of -3.28, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174536512 is sourced from PubChem (CID 174536512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).