(6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane

C20H32O2Si2 — CID 57374260

IUPAC(6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane
SMILESCC1=C(O[Si](C)(C)C)c2ccccc2C(O[Si](C)(C)C)=C(C)CC1
InChIInChI=1S/C20H32O2Si2/c1-15-13-14-16(2)20(22-24(6,7)8)18-12-10-9-11-17(18)19(15)21-23(3,4)5/h9-12H,13-14H2,1-8H3
InChIKeyGTIDMDLXHUABGP-UHFFFAOYSA-N
MW360.65 g/mol
LogP6.65
Rot. Bonds4

About (6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane

(6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane (PubChem CID 57374260) has the molecular formula C20H32O2Si2 and a molecular weight of 360.65 g/mol. Its IUPAC name is (6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane.

Molecular Properties

Compound Name(6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane
PubChem CID57374260
Molecular FormulaC20H32O2Si2
Molecular Weight360.65 g/mol
Exact Mass360.19
IUPAC Name(6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane
SMILESCC1=C(O[Si](C)(C)C)c2ccccc2C(O[Si](C)(C)C)=C(C)CC1
InChIInChI=1S/C20H32O2Si2/c1-15-13-14-16(2)20(22-24(6,7)8)18-12-10-9-11-17(18)19(15)21-23(3,4)5/h9-12H,13-14H2,1-8H3
InChIKeyGTIDMDLXHUABGP-UHFFFAOYSA-N
XLogP6.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.65
LogP ≤ 56.65
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 (6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane?
The IUPAC name of (6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane (CID 57374260) is (6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane.
What is the SMILES notation for (6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane?
The canonical SMILES for (6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane is CC1=C(O[Si](C)(C)C)c2ccccc2C(O[Si](C)(C)C)=C(C)CC1.
What is the InChIKey of (6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane?
The InChIKey is GTIDMDLXHUABGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32O2Si2/c1-15-13-14-16(2)20(22-24(6,7)8)18-12-10-9-11-17(18)19(15)21-23(3,4)5/h9-12H,13-14H2,1-8H3.
What are the key properties of (6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane?
(6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane has a molecular weight of 360.65 g/mol, XLogP of 6.65, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6,9-dimethyl-5-trimethylsilyloxy-7,8-dihydrobenzo[8]annulen-10-yl)oxy-trimethylsilane is sourced from PubChem (CID 57374260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).