CID 174455312

C10H13Si — CID 174455312

IUPAC—
SMILESCc1cc(C)c([Si])c(C)c1C
InChIInChI=1S/C10H13Si/c1-6-5-7(2)10(11)9(4)8(6)3/h5H,1-4H3
InChIKeyQDQDGFLYAHMFII-UHFFFAOYSA-N
MW161.30 g/mol
LogP1.71
Rot. Bonds

About CID 174455312

CID 174455312 (PubChem CID 174455312) has the molecular formula C10H13Si and a molecular weight of 161.30 g/mol.

Molecular Properties

Compound NameCID 174455312
PubChem CID174455312
Molecular FormulaC10H13Si
Molecular Weight161.30 g/mol
Exact Mass161.08
IUPAC Name—
SMILESCc1cc(C)c([Si])c(C)c1C
InChIInChI=1S/C10H13Si/c1-6-5-7(2)10(11)9(4)8(6)3/h5H,1-4H3
InChIKeyQDQDGFLYAHMFII-UHFFFAOYSA-N
XLogP1.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.30
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 174455312?
The IUPAC name of CID 174455312 (CID 174455312) is not available.
What is the SMILES notation for CID 174455312?
The canonical SMILES for CID 174455312 is Cc1cc(C)c([Si])c(C)c1C.
What is the InChIKey of CID 174455312?
The InChIKey is QDQDGFLYAHMFII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Si/c1-6-5-7(2)10(11)9(4)8(6)3/h5H,1-4H3.
What are the key properties of CID 174455312?
CID 174455312 has a molecular weight of 161.30 g/mol, XLogP of 1.71, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174455312 is sourced from PubChem (CID 174455312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).