Hexamesitylcyclotrigermane

C54H66Ge3 — CID 11007522

IUPAC—
SMILESCc1cc(C)c([Ge]c2c(C)cc(C)cc2C)c(C)c1.Cc1cc(C)c([Ge]c2c(C)cc(C)cc2C)c(C)c1.Cc1cc(C)c([Ge]c2c(C)cc(C)cc2C)c(C)c1
InChIInChI=1S/3C18H22Ge/c3*1-11-7-13(3)17(14(4)8-11)19-18-15(5)9-12(2)10-16(18)6/h3*7-10H,1-6H3
InChIKeyNCTGXCQDGDZJPW-UHFFFAOYSA-N
MW932.95 g/mol
LogP9.58
Rot. Bonds6

About Hexamesitylcyclotrigermane

Hexamesitylcyclotrigermane (PubChem CID 11007522) has the molecular formula C54H66Ge3 and a molecular weight of 932.95 g/mol.

Molecular Properties

Compound NameHexamesitylcyclotrigermane
PubChem CID11007522
Molecular FormulaC54H66Ge3
Molecular Weight932.95 g/mol
Exact Mass936.28
IUPAC Name—
SMILESCc1cc(C)c([Ge]c2c(C)cc(C)cc2C)c(C)c1.Cc1cc(C)c([Ge]c2c(C)cc(C)cc2C)c(C)c1.Cc1cc(C)c([Ge]c2c(C)cc(C)cc2C)c(C)c1
InChIInChI=1S/3C18H22Ge/c3*1-11-7-13(3)17(14(4)8-11)19-18-15(5)9-12(2)10-16(18)6/h3*7-10H,1-6H3
InChIKeyNCTGXCQDGDZJPW-UHFFFAOYSA-N
XLogP9.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500932.95
LogP ≤ 59.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of Hexamesitylcyclotrigermane?
The IUPAC name of Hexamesitylcyclotrigermane (CID 11007522) is not available.
What is the SMILES notation for Hexamesitylcyclotrigermane?
The canonical SMILES for Hexamesitylcyclotrigermane is Cc1cc(C)c([Ge]c2c(C)cc(C)cc2C)c(C)c1.Cc1cc(C)c([Ge]c2c(C)cc(C)cc2C)c(C)c1.Cc1cc(C)c([Ge]c2c(C)cc(C)cc2C)c(C)c1.
What is the InChIKey of Hexamesitylcyclotrigermane?
The InChIKey is NCTGXCQDGDZJPW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C18H22Ge/c3*1-11-7-13(3)17(14(4)8-11)19-18-15(5)9-12(2)10-16(18)6/h3*7-10H,1-6H3.
What are the key properties of Hexamesitylcyclotrigermane?
Hexamesitylcyclotrigermane has a molecular weight of 932.95 g/mol, XLogP of 9.58, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Hexamesitylcyclotrigermane is sourced from PubChem (CID 11007522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).