CID 22259720

C18H26Si — CID 22259720

IUPAC—
SMILESCC1=CC(C)(C)C([Si]C2=C(C)C(C)=CC2(C)C)=C1C
InChIInChI=1S/C18H26Si/c1-11-9-17(5,6)15(13(11)3)19-16-14(4)12(2)10-18(16,7)8/h9-10H,1-8H3
InChIKeyDVVOMGCALCKPAU-UHFFFAOYSA-N
MW270.49 g/mol
LogP5.21
Rot. Bonds2

About CID 22259720

CID 22259720 (PubChem CID 22259720) has the molecular formula C18H26Si and a molecular weight of 270.49 g/mol.

Molecular Properties

Compound NameCID 22259720
PubChem CID22259720
Molecular FormulaC18H26Si
Molecular Weight270.49 g/mol
Exact Mass270.18
IUPAC Name—
SMILESCC1=CC(C)(C)C([Si]C2=C(C)C(C)=CC2(C)C)=C1C
InChIInChI=1S/C18H26Si/c1-11-9-17(5,6)15(13(11)3)19-16-14(4)12(2)10-18(16,7)8/h9-10H,1-8H3
InChIKeyDVVOMGCALCKPAU-UHFFFAOYSA-N
XLogP5.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.49
LogP ≤ 55.21
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 22259720?
The IUPAC name of CID 22259720 (CID 22259720) is not available.
What is the SMILES notation for CID 22259720?
The canonical SMILES for CID 22259720 is CC1=CC(C)(C)C([Si]C2=C(C)C(C)=CC2(C)C)=C1C.
What is the InChIKey of CID 22259720?
The InChIKey is DVVOMGCALCKPAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26Si/c1-11-9-17(5,6)15(13(11)3)19-16-14(4)12(2)10-18(16,7)8/h9-10H,1-8H3.
What are the key properties of CID 22259720?
CID 22259720 has a molecular weight of 270.49 g/mol, XLogP of 5.21, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22259720 is sourced from PubChem (CID 22259720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).