dichloro-bis(2,3,4-trimethylphenyl)silane

C18H22Cl2Si — CID 141040202

IUPACdichloro-bis(2,3,4-trimethylphenyl)silane
SMILESCc1ccc([Si](Cl)(Cl)c2ccc(C)c(C)c2C)c(C)c1C
InChIInChI=1S/C18H22Cl2Si/c1-11-7-9-17(15(5)13(11)3)21(19,20)18-10-8-12(2)14(4)16(18)6/h7-10H,1-6H3
InChIKeyHKXZBUGOMWTNMD-UHFFFAOYSA-N
MW337.37 g/mol
LogP4.57
Rot. Bonds2

About dichloro-bis(2,3,4-trimethylphenyl)silane

dichloro-bis(2,3,4-trimethylphenyl)silane (PubChem CID 141040202) has the molecular formula C18H22Cl2Si and a molecular weight of 337.37 g/mol. Its IUPAC name is dichloro-bis(2,3,4-trimethylphenyl)silane.

Molecular Properties

Compound Namedichloro-bis(2,3,4-trimethylphenyl)silane
PubChem CID141040202
Molecular FormulaC18H22Cl2Si
Molecular Weight337.37 g/mol
Exact Mass336.09
IUPAC Namedichloro-bis(2,3,4-trimethylphenyl)silane
SMILESCc1ccc([Si](Cl)(Cl)c2ccc(C)c(C)c2C)c(C)c1C
InChIInChI=1S/C18H22Cl2Si/c1-11-7-9-17(15(5)13(11)3)21(19,20)18-10-8-12(2)14(4)16(18)6/h7-10H,1-6H3
InChIKeyHKXZBUGOMWTNMD-UHFFFAOYSA-N
XLogP4.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.37
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dichloro-bis(2,3,4-trimethylphenyl)silane?
The IUPAC name of dichloro-bis(2,3,4-trimethylphenyl)silane (CID 141040202) is dichloro-bis(2,3,4-trimethylphenyl)silane.
What is the SMILES notation for dichloro-bis(2,3,4-trimethylphenyl)silane?
The canonical SMILES for dichloro-bis(2,3,4-trimethylphenyl)silane is Cc1ccc([Si](Cl)(Cl)c2ccc(C)c(C)c2C)c(C)c1C.
What is the InChIKey of dichloro-bis(2,3,4-trimethylphenyl)silane?
The InChIKey is HKXZBUGOMWTNMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22Cl2Si/c1-11-7-9-17(15(5)13(11)3)21(19,20)18-10-8-12(2)14(4)16(18)6/h7-10H,1-6H3.
What are the key properties of dichloro-bis(2,3,4-trimethylphenyl)silane?
dichloro-bis(2,3,4-trimethylphenyl)silane has a molecular weight of 337.37 g/mol, XLogP of 4.57, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-bis(2,3,4-trimethylphenyl)silane is sourced from PubChem (CID 141040202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).