1,2,3,4,5,6-hexamethylbenzene

C12H18 — CID 6908

IUPAC1,2,3,4,5,6-hexamethylbenzene
SMILESCc1c(C)c(C)c(C)c(C)c1C
InChIInChI=1S/C12H18/c1-7-8(2)10(4)12(6)11(5)9(7)3/h1-6H3
InChIKeyYUWFEBAXEOLKSG-UHFFFAOYSA-N
MW162.28 g/mol
LogP3.54
Rot. Bonds

About 1,2,3,4,5,6-hexamethylbenzene

1,2,3,4,5,6-hexamethylbenzene (PubChem CID 6908) has the molecular formula C12H18 and a molecular weight of 162.28 g/mol. Its IUPAC name is 1,2,3,4,5,6-hexamethylbenzene.

Molecular Properties

Compound Name1,2,3,4,5,6-hexamethylbenzene
PubChem CID6908
Molecular FormulaC12H18
Molecular Weight162.28 g/mol
Exact Mass162.14
IUPAC Name1,2,3,4,5,6-hexamethylbenzene
SMILESCc1c(C)c(C)c(C)c(C)c1C
InChIInChI=1S/C12H18/c1-7-8(2)10(4)12(6)11(5)9(7)3/h1-6H3
InChIKeyYUWFEBAXEOLKSG-UHFFFAOYSA-N
XLogP3.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6-hexamethylbenzene?
The IUPAC name of 1,2,3,4,5,6-hexamethylbenzene (CID 6908) is 1,2,3,4,5,6-hexamethylbenzene.
What is the SMILES notation for 1,2,3,4,5,6-hexamethylbenzene?
The canonical SMILES for 1,2,3,4,5,6-hexamethylbenzene is Cc1c(C)c(C)c(C)c(C)c1C.
What is the InChIKey of 1,2,3,4,5,6-hexamethylbenzene?
The InChIKey is YUWFEBAXEOLKSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18/c1-7-8(2)10(4)12(6)11(5)9(7)3/h1-6H3.
What are the key properties of 1,2,3,4,5,6-hexamethylbenzene?
1,2,3,4,5,6-hexamethylbenzene has a molecular weight of 162.28 g/mol, XLogP of 3.54, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6-hexamethylbenzene is sourced from PubChem (CID 6908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).