ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene

C24H36 — CID 91299568

IUPACethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene
SMILESCC.Cc1cc(C)c(C)c(Cc2c(C)c(C)c(C)c(C)c2C)c1C
InChIInChI=1S/C22H30.C2H6/c1-12-10-13(2)15(4)21(14(12)3)11-22-19(8)17(6)16(5)18(7)20(22)9;1-2/h10H,11H2,1-9H3;1-2H3
InChIKeyHVEXZODDNQLVMQ-UHFFFAOYSA-N
MW324.55 g/mol
LogP7.08
Rot. Bonds2

About ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene

ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene (PubChem CID 91299568) has the molecular formula C24H36 and a molecular weight of 324.55 g/mol. Its IUPAC name is ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene.

Molecular Properties

Compound Nameethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene
PubChem CID91299568
Molecular FormulaC24H36
Molecular Weight324.55 g/mol
Exact Mass324.28
IUPAC Nameethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene
SMILESCC.Cc1cc(C)c(C)c(Cc2c(C)c(C)c(C)c(C)c2C)c1C
InChIInChI=1S/C22H30.C2H6/c1-12-10-13(2)15(4)21(14(12)3)11-22-19(8)17(6)16(5)18(7)20(22)9;1-2/h10H,11H2,1-9H3;1-2H3
InChIKeyHVEXZODDNQLVMQ-UHFFFAOYSA-N
XLogP7.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.55
LogP ≤ 57.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene?
The IUPAC name of ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene (CID 91299568) is ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene.
What is the SMILES notation for ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene?
The canonical SMILES for ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene is CC.Cc1cc(C)c(C)c(Cc2c(C)c(C)c(C)c(C)c2C)c1C.
What is the InChIKey of ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene?
The InChIKey is HVEXZODDNQLVMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30.C2H6/c1-12-10-13(2)15(4)21(14(12)3)11-22-19(8)17(6)16(5)18(7)20(22)9;1-2/h10H,11H2,1-9H3;1-2H3.
What are the key properties of ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene?
ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene has a molecular weight of 324.55 g/mol, XLogP of 7.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1,2,3,4,5-pentamethyl-6-[(2,3,5,6-tetramethylphenyl)methyl]benzene is sourced from PubChem (CID 91299568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).