CID 153322216

C15H15BrSi — CID 153322216

IUPAC—
SMILESCc1ccccc1C([Si]Br)c1ccccc1C
InChIInChI=1S/C15H15BrSi/c1-11-7-3-5-9-13(11)15(17-16)14-10-6-4-8-12(14)2/h3-10,15H,1-2H3
InChIKeyFWTCVFPNMVZAHO-UHFFFAOYSA-N
MW303.27 g/mol
LogP4.41
Rot. Bonds3

About CID 153322216

CID 153322216 (PubChem CID 153322216) has the molecular formula C15H15BrSi and a molecular weight of 303.27 g/mol.

Molecular Properties

Compound NameCID 153322216
PubChem CID153322216
Molecular FormulaC15H15BrSi
Molecular Weight303.27 g/mol
Exact Mass302.01
IUPAC Name—
SMILESCc1ccccc1C([Si]Br)c1ccccc1C
InChIInChI=1S/C15H15BrSi/c1-11-7-3-5-9-13(11)15(17-16)14-10-6-4-8-12(14)2/h3-10,15H,1-2H3
InChIKeyFWTCVFPNMVZAHO-UHFFFAOYSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.27
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 153322216 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 66989853
CID 66989853
CID 66989877
CID 66989877
CID 175409940
CID 175409940
CID 174622324
CID 174622324
CID 88514856
CID 88514856
1-[bromo(phenyl)methyl]-2-methylbenzene
CID 12875470
[(S)-bromo-(2-methylphenyl)methyl] hypobromite
CID 124639484
1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene
CID 14267704
CID 67747413
CID 67747413
bis((1S)-1-(2-methylphenyl)ethanamine);dihydrochloride
CID 134129357
1-(1-bromo-3-phenylpropan-2-yl)-2-methylbenzene
CID 79418449
1-(1-bromo-5-methylhexan-2-yl)-2-methylbenzene
CID 79418529

Frequently Asked Questions

What is the IUPAC name of CID 153322216?
The IUPAC name of CID 153322216 (CID 153322216) is not available.
What is the SMILES notation for CID 153322216?
The canonical SMILES for CID 153322216 is Cc1ccccc1C([Si]Br)c1ccccc1C.
What is the InChIKey of CID 153322216?
The InChIKey is FWTCVFPNMVZAHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrSi/c1-11-7-3-5-9-13(11)15(17-16)14-10-6-4-8-12(14)2/h3-10,15H,1-2H3.
What are the key properties of CID 153322216?
CID 153322216 has a molecular weight of 303.27 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 153322216 is sourced from PubChem (CID 153322216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).