1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene

C14H24 — CID 600938

IUPAC1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene
SMILESCC1=C(C)C(C)(C)C(C)(C)C(C)=C1C
InChIInChI=1S/C14H24/c1-9-10(2)12(4)14(7,8)13(5,6)11(9)3/h1-8H3
InChIKeyOQHUDOXMKAJMBU-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.73
Rot. Bonds

About 1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene

1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene (PubChem CID 600938) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene.

Molecular Properties

Compound Name1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene
PubChem CID600938
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene
SMILESCC1=C(C)C(C)(C)C(C)(C)C(C)=C1C
InChIInChI=1S/C14H24/c1-9-10(2)12(4)14(7,8)13(5,6)11(9)3/h1-8H3
InChIKeyOQHUDOXMKAJMBU-UHFFFAOYSA-N
XLogP4.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene?
The IUPAC name of 1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene (CID 600938) is 1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene.
What is the SMILES notation for 1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene?
The canonical SMILES for 1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene is CC1=C(C)C(C)(C)C(C)(C)C(C)=C1C.
What is the InChIKey of 1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene?
The InChIKey is OQHUDOXMKAJMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-9-10(2)12(4)14(7,8)13(5,6)11(9)3/h1-8H3.
What are the key properties of 1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene?
1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene has a molecular weight of 192.35 g/mol, XLogP of 4.73, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,5,6,6-octamethylcyclohexa-1,3-diene is sourced from PubChem (CID 600938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).