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

C12H24 — CID 528241

IUPAC1,2,3,4,5,6-hexamethylcyclohexane
SMILESCC1C(C)C(C)C(C)C(C)C1C
InChIInChI=1S/C12H24/c1-7-8(2)10(4)12(6)11(5)9(7)3/h7-12H,1-6H3
InChIKeyCRZVDNMIWUHMQA-UHFFFAOYSA-N
MW168.32 g/mol
LogP3.82
Rot. Bonds

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

1,2,3,4,5,6-hexamethylcyclohexane (PubChem CID 528241) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 1,2,3,4,5,6-hexamethylcyclohexane.

Molecular Properties

Compound Name1,2,3,4,5,6-hexamethylcyclohexane
PubChem CID528241
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name1,2,3,4,5,6-hexamethylcyclohexane
SMILESCC1C(C)C(C)C(C)C(C)C1C
InChIInChI=1S/C12H24/c1-7-8(2)10(4)12(6)11(5)9(7)3/h7-12H,1-6H3
InChIKeyCRZVDNMIWUHMQA-UHFFFAOYSA-N
XLogP3.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 53.82
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-hexamethylcyclohexane?
The IUPAC name of 1,2,3,4,5,6-hexamethylcyclohexane (CID 528241) is 1,2,3,4,5,6-hexamethylcyclohexane.
What is the SMILES notation for 1,2,3,4,5,6-hexamethylcyclohexane?
The canonical SMILES for 1,2,3,4,5,6-hexamethylcyclohexane is CC1C(C)C(C)C(C)C(C)C1C.
What is the InChIKey of 1,2,3,4,5,6-hexamethylcyclohexane?
The InChIKey is CRZVDNMIWUHMQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-7-8(2)10(4)12(6)11(5)9(7)3/h7-12H,1-6H3.
What are the key properties of 1,2,3,4,5,6-hexamethylcyclohexane?
1,2,3,4,5,6-hexamethylcyclohexane has a molecular weight of 168.32 g/mol, XLogP of 3.82, 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-hexamethylcyclohexane is sourced from PubChem (CID 528241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).