CID 174955573

C19H17O2Si — CID 174955573

IUPAC—
SMILESCOc1ccccc1O[Si](c1ccccc1)c1ccccc1
InChIInChI=1S/C19H17O2Si/c1-20-18-14-8-9-15-19(18)21-22(16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-15H,1H3
InChIKeyOKSJTZWXHAKVRU-UHFFFAOYSA-N
MW305.43 g/mol
LogP2.88
Rot. Bonds5

About CID 174955573

CID 174955573 (PubChem CID 174955573) has the molecular formula C19H17O2Si and a molecular weight of 305.43 g/mol.

Molecular Properties

Compound NameCID 174955573
PubChem CID174955573
Molecular FormulaC19H17O2Si
Molecular Weight305.43 g/mol
Exact Mass305.10
IUPAC Name—
SMILESCOc1ccccc1O[Si](c1ccccc1)c1ccccc1
InChIInChI=1S/C19H17O2Si/c1-20-18-14-8-9-15-19(18)21-22(16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-15H,1H3
InChIKeyOKSJTZWXHAKVRU-UHFFFAOYSA-N
XLogP2.88
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 174955573?
The IUPAC name of CID 174955573 (CID 174955573) is not available.
What is the SMILES notation for CID 174955573?
The canonical SMILES for CID 174955573 is COc1ccccc1O[Si](c1ccccc1)c1ccccc1.
What is the InChIKey of CID 174955573?
The InChIKey is OKSJTZWXHAKVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17O2Si/c1-20-18-14-8-9-15-19(18)21-22(16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-15H,1H3.
What are the key properties of CID 174955573?
CID 174955573 has a molecular weight of 305.43 g/mol, XLogP of 2.88, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174955573 is sourced from PubChem (CID 174955573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).