6,7-dimethyldeca-3,4-diene

C12H22 — CID 123960916

IUPAC6,7-dimethyldeca-3,4-diene
SMILESCCC=C=CC(C)C(C)CCC
InChIInChI=1S/C12H22/c1-5-7-8-10-12(4)11(3)9-6-2/h7,10-12H,5-6,9H2,1-4H3
InChIKeyRZGMFOGRXNGPNE-UHFFFAOYSA-N
MW166.31 g/mol
LogP4.18
Rot. Bonds5

About 6,7-dimethyldeca-3,4-diene

6,7-dimethyldeca-3,4-diene (PubChem CID 123960916) has the molecular formula C12H22 and a molecular weight of 166.31 g/mol. Its IUPAC name is 6,7-dimethyldeca-3,4-diene.

Molecular Properties

Compound Name6,7-dimethyldeca-3,4-diene
PubChem CID123960916
Molecular FormulaC12H22
Molecular Weight166.31 g/mol
Exact Mass166.17
IUPAC Name6,7-dimethyldeca-3,4-diene
SMILESCCC=C=CC(C)C(C)CCC
InChIInChI=1S/C12H22/c1-5-7-8-10-12(4)11(3)9-6-2/h7,10-12H,5-6,9H2,1-4H3
InChIKeyRZGMFOGRXNGPNE-UHFFFAOYSA-N
XLogP4.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.31
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-methylocta-3,4-diene
CID 123388869
5-methylocta-2,3-diene
CID 123151584
8-ethyl-9-methyldodeca-4,5-diene
CID 123744069
3,4,5-trimethyloct-1-ene
CID 123841596
(3R)-3,4-dimethylheptane
CID 59819300
5-tert-butyl-4,6-dimethylnonane
CID 91526510
4,5-dimethylicos-6-ene
CID 72645531
4-methylheptane;propane
CID 142171269
2-methylocta-3,4,5-triene
CID 123654012
2,4-dimethyl-3-propan-2-ylheptane
CID 53423714
(2S,3R)-2-fluoro-3-methylhexane
CID 142291573
(2R)-3-methylhexan-2-ol
CID 88692749

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyldeca-3,4-diene?
The IUPAC name of 6,7-dimethyldeca-3,4-diene (CID 123960916) is 6,7-dimethyldeca-3,4-diene.
What is the SMILES notation for 6,7-dimethyldeca-3,4-diene?
The canonical SMILES for 6,7-dimethyldeca-3,4-diene is CCC=C=CC(C)C(C)CCC.
What is the InChIKey of 6,7-dimethyldeca-3,4-diene?
The InChIKey is RZGMFOGRXNGPNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22/c1-5-7-8-10-12(4)11(3)9-6-2/h7,10-12H,5-6,9H2,1-4H3.
What are the key properties of 6,7-dimethyldeca-3,4-diene?
6,7-dimethyldeca-3,4-diene has a molecular weight of 166.31 g/mol, XLogP of 4.18, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyldeca-3,4-diene is sourced from PubChem (CID 123960916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).