(7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane

C18H22Cl2Si2 — CID 135028132

IUPAC(7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane
SMILESC[Si](C)(C)c1ccc2c(c1[Si](C)(C)C)-c1c-2ccc(Cl)c1Cl
InChIInChI=1S/C18H22Cl2Si2/c1-21(2,3)14-10-8-12-11-7-9-13(19)17(20)15(11)16(12)18(14)22(4,5)6/h7-10H,1-6H3
InChIKeySMCHMDDQPHTBIW-UHFFFAOYSA-N
MW365.45 g/mol
LogP5.73
Rot. Bonds2

About (7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane

(7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane (PubChem CID 135028132) has the molecular formula C18H22Cl2Si2 and a molecular weight of 365.45 g/mol. Its IUPAC name is (7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane.

Molecular Properties

Compound Name(7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane
PubChem CID135028132
Molecular FormulaC18H22Cl2Si2
Molecular Weight365.45 g/mol
Exact Mass364.06
IUPAC Name(7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane
SMILESC[Si](C)(C)c1ccc2c(c1[Si](C)(C)C)-c1c-2ccc(Cl)c1Cl
InChIInChI=1S/C18H22Cl2Si2/c1-21(2,3)14-10-8-12-11-7-9-13(19)17(20)15(11)16(12)18(14)22(4,5)6/h7-10H,1-6H3
InChIKeySMCHMDDQPHTBIW-UHFFFAOYSA-N
XLogP5.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.45
LogP ≤ 55.73
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 (7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane?
The IUPAC name of (7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane (CID 135028132) is (7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane.
What is the SMILES notation for (7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane?
The canonical SMILES for (7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane is C[Si](C)(C)c1ccc2c(c1[Si](C)(C)C)-c1c-2ccc(Cl)c1Cl.
What is the InChIKey of (7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane?
The InChIKey is SMCHMDDQPHTBIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22Cl2Si2/c1-21(2,3)14-10-8-12-11-7-9-13(19)17(20)15(11)16(12)18(14)22(4,5)6/h7-10H,1-6H3.
What are the key properties of (7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane?
(7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane has a molecular weight of 365.45 g/mol, XLogP of 5.73, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (7,8-dichloro-1-trimethylsilylbiphenylen-2-yl)-trimethylsilane is sourced from PubChem (CID 135028132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).