(6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane

C18H22Cl2Si2 — CID 13487543

IUPAC(6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane
SMILESC[Si](C)(C)c1cc2c(cc1[Si](C)(C)C)-c1cc(Cl)c(Cl)cc1-2
InChIInChI=1S/C18H22Cl2Si2/c1-21(2,3)17-9-13-11-7-15(19)16(20)8-12(11)14(13)10-18(17)22(4,5)6/h7-10H,1-6H3
InChIKeyUFLGHWLYVVQKSA-UHFFFAOYSA-N
MW365.45 g/mol
LogP5.73
Rot. Bonds2

About (6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane

(6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane (PubChem CID 13487543) has the molecular formula C18H22Cl2Si2 and a molecular weight of 365.45 g/mol. Its IUPAC name is (6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane.

Molecular Properties

Compound Name(6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane
PubChem CID13487543
Molecular FormulaC18H22Cl2Si2
Molecular Weight365.45 g/mol
Exact Mass364.06
IUPAC Name(6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane
SMILESC[Si](C)(C)c1cc2c(cc1[Si](C)(C)C)-c1cc(Cl)c(Cl)cc1-2
InChIInChI=1S/C18H22Cl2Si2/c1-21(2,3)17-9-13-11-7-15(19)16(20)8-12(11)14(13)10-18(17)22(4,5)6/h7-10H,1-6H3
InChIKeyUFLGHWLYVVQKSA-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 (6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane?
The IUPAC name of (6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane (CID 13487543) is (6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane.
What is the SMILES notation for (6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane?
The canonical SMILES for (6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane is C[Si](C)(C)c1cc2c(cc1[Si](C)(C)C)-c1cc(Cl)c(Cl)cc1-2.
What is the InChIKey of (6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane?
The InChIKey is UFLGHWLYVVQKSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22Cl2Si2/c1-21(2,3)17-9-13-11-7-15(19)16(20)8-12(11)14(13)10-18(17)22(4,5)6/h7-10H,1-6H3.
What are the key properties of (6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane?
(6,7-dichloro-3-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 (6,7-dichloro-3-trimethylsilylbiphenylen-2-yl)-trimethylsilane is sourced from PubChem (CID 13487543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).