dichloro-bis[(3,4-dimethylphenyl)methyl]stannane

C18H22Cl2Sn — CID 71373322

IUPACdichloro-bis[(3,4-dimethylphenyl)methyl]stannane
SMILESCc1ccc(C[Sn](Cl)(Cl)Cc2ccc(C)c(C)c2)cc1C
InChIInChI=1S/2C9H11.2ClH.Sn/c2*1-7-4-5-8(2)9(3)6-7;;;/h2*4-6H,1H2,2-3H3;2*1H;/q;;;;+2/p-2
InChIKeyRHVYOZNTQNNFFJ-UHFFFAOYSA-L
MW427.99 g/mol
LogP5.70
Rot. Bonds4

About dichloro-bis[(3,4-dimethylphenyl)methyl]stannane

dichloro-bis[(3,4-dimethylphenyl)methyl]stannane (PubChem CID 71373322) has the molecular formula C18H22Cl2Sn and a molecular weight of 427.99 g/mol. Its IUPAC name is dichloro-bis[(3,4-dimethylphenyl)methyl]stannane.

Molecular Properties

Compound Namedichloro-bis[(3,4-dimethylphenyl)methyl]stannane
PubChem CID71373322
Molecular FormulaC18H22Cl2Sn
Molecular Weight427.99 g/mol
Exact Mass428.01
IUPAC Namedichloro-bis[(3,4-dimethylphenyl)methyl]stannane
SMILESCc1ccc(C[Sn](Cl)(Cl)Cc2ccc(C)c(C)c2)cc1C
InChIInChI=1S/2C9H11.2ClH.Sn/c2*1-7-4-5-8(2)9(3)6-7;;;/h2*4-6H,1H2,2-3H3;2*1H;/q;;;;+2/p-2
InChIKeyRHVYOZNTQNNFFJ-UHFFFAOYSA-L
XLogP5.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.99
LogP ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of dichloro-bis[(3,4-dimethylphenyl)methyl]stannane?
The IUPAC name of dichloro-bis[(3,4-dimethylphenyl)methyl]stannane (CID 71373322) is dichloro-bis[(3,4-dimethylphenyl)methyl]stannane.
What is the SMILES notation for dichloro-bis[(3,4-dimethylphenyl)methyl]stannane?
The canonical SMILES for dichloro-bis[(3,4-dimethylphenyl)methyl]stannane is Cc1ccc(C[Sn](Cl)(Cl)Cc2ccc(C)c(C)c2)cc1C.
What is the InChIKey of dichloro-bis[(3,4-dimethylphenyl)methyl]stannane?
The InChIKey is RHVYOZNTQNNFFJ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C9H11.2ClH.Sn/c2*1-7-4-5-8(2)9(3)6-7;;;/h2*4-6H,1H2,2-3H3;2*1H;/q;;;;+2/p-2.
What are the key properties of dichloro-bis[(3,4-dimethylphenyl)methyl]stannane?
dichloro-bis[(3,4-dimethylphenyl)methyl]stannane has a molecular weight of 427.99 g/mol, XLogP of 5.70, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-bis[(3,4-dimethylphenyl)methyl]stannane is sourced from PubChem (CID 71373322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).