(2E,6E)-4,8-dimethyldeca-2,6-diene

C12H22 — CID 173250236

IUPAC(2E,6E)-4,8-dimethyldeca-2,6-diene
SMILESC/C=C/C(C)C/C=C/C(C)CC
InChIInChI=1S/C12H22/c1-5-8-12(4)10-7-9-11(3)6-2/h5,7-9,11-12H,6,10H2,1-4H3/b8-5+,9-7+
InChIKeyDTDZBKJYRBFISR-OCIXRKKMSA-N
MW166.31 g/mol
LogP4.19
Rot. Bonds5

About (2E,6E)-4,8-dimethyldeca-2,6-diene

(2E,6E)-4,8-dimethyldeca-2,6-diene (PubChem CID 173250236) has the molecular formula C12H22 and a molecular weight of 166.31 g/mol. Its IUPAC name is (2E,6E)-4,8-dimethyldeca-2,6-diene.

Molecular Properties

Compound Name(2E,6E)-4,8-dimethyldeca-2,6-diene
PubChem CID173250236
Molecular FormulaC12H22
Molecular Weight166.31 g/mol
Exact Mass166.17
IUPAC Name(2E,6E)-4,8-dimethyldeca-2,6-diene
SMILESC/C=C/C(C)C/C=C/C(C)CC
InChIInChI=1S/C12H22/c1-5-8-12(4)10-7-9-11(3)6-2/h5,7-9,11-12H,6,10H2,1-4H3/b8-5+,9-7+
InChIKeyDTDZBKJYRBFISR-OCIXRKKMSA-N
XLogP4.19
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 ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4,8-dimethylnona-2,6-diene
CID 54128177
3,7,8-trimethylnon-4-ene
CID 91465939
(4E,8E)-3,7-dimethyldeca-1,4,8-triene
CID 22679021
4-methylundeca-2,6-diene
CID 173179145
(Z)-5-methylhept-3-ene
CID 5364727
(4E,8E)-7-methyldeca-1,4,8-triene
CID 20695287
3,6-dimethyloct-4-ene
CID 73165576
(Z)-4-methylhept-2-ene
CID 5352649
2,2,6-trimethyloct-4-ene
CID 91281227
methylcyclobutane;(Z)-4-methylhex-2-ene
CID 142208255
(E)-4-methylhex-2-en-1-ol
CID 12036147
(3R,7R)-3,7-dimethylnon-5-enenitrile
CID 91063106

Frequently Asked Questions

What is the IUPAC name of (2E,6E)-4,8-dimethyldeca-2,6-diene?
The IUPAC name of (2E,6E)-4,8-dimethyldeca-2,6-diene (CID 173250236) is (2E,6E)-4,8-dimethyldeca-2,6-diene.
What is the SMILES notation for (2E,6E)-4,8-dimethyldeca-2,6-diene?
The canonical SMILES for (2E,6E)-4,8-dimethyldeca-2,6-diene is C/C=C/C(C)C/C=C/C(C)CC.
What is the InChIKey of (2E,6E)-4,8-dimethyldeca-2,6-diene?
The InChIKey is DTDZBKJYRBFISR-OCIXRKKMSA-N. The full InChI is InChI=1S/C12H22/c1-5-8-12(4)10-7-9-11(3)6-2/h5,7-9,11-12H,6,10H2,1-4H3/b8-5+,9-7+.
What are the key properties of (2E,6E)-4,8-dimethyldeca-2,6-diene?
(2E,6E)-4,8-dimethyldeca-2,6-diene has a molecular weight of 166.31 g/mol, XLogP of 4.19, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,6E)-4,8-dimethyldeca-2,6-diene is sourced from PubChem (CID 173250236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).