CID 10809432

C27H21Si — CID 10809432

IUPAC—
SMILESC1=CC([Si](C2C=Cc3ccccc32)C2C=Cc3ccccc32)c2ccccc21
InChIInChI=1S/C27H21Si/c1-4-10-22-19(7-1)13-16-25(22)28(26-17-14-20-8-2-5-11-23(20)26)27-18-15-21-9-3-6-12-24(21)27/h1-18,25-27H
InChIKeyPDQIJIKYMIEHTJ-UHFFFAOYSA-N
MW373.55 g/mol
LogP6.53
Rot. Bonds3

About CID 10809432

CID 10809432 (PubChem CID 10809432) has the molecular formula C27H21Si and a molecular weight of 373.55 g/mol.

Molecular Properties

Compound NameCID 10809432
PubChem CID10809432
Molecular FormulaC27H21Si
Molecular Weight373.55 g/mol
Exact Mass373.14
IUPAC Name—
SMILESC1=CC([Si](C2C=Cc3ccccc32)C2C=Cc3ccccc32)c2ccccc21
InChIInChI=1S/C27H21Si/c1-4-10-22-19(7-1)13-16-25(22)28(26-17-14-20-8-2-5-11-23(20)26)27-18-15-21-9-3-6-12-24(21)27/h1-18,25-27H
InChIKeyPDQIJIKYMIEHTJ-UHFFFAOYSA-N
XLogP6.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.55
LogP ≤ 56.53
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 10809432?
The IUPAC name of CID 10809432 (CID 10809432) is not available.
What is the SMILES notation for CID 10809432?
The canonical SMILES for CID 10809432 is C1=CC([Si](C2C=Cc3ccccc32)C2C=Cc3ccccc32)c2ccccc21.
What is the InChIKey of CID 10809432?
The InChIKey is PDQIJIKYMIEHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H21Si/c1-4-10-22-19(7-1)13-16-25(22)28(26-17-14-20-8-2-5-11-23(20)26)27-18-15-21-9-3-6-12-24(21)27/h1-18,25-27H.
What are the key properties of CID 10809432?
CID 10809432 has a molecular weight of 373.55 g/mol, XLogP of 6.53, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10809432 is sourced from PubChem (CID 10809432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).