2,6-dimethylocta-1,5-diene

C10H18 — CID 54025904

IUPAC2,6-dimethylocta-1,5-diene
SMILESC=C(C)CCC=C(C)CC
InChIInChI=1S/C10H18/c1-5-10(4)8-6-7-9(2)3/h8H,2,5-7H2,1,3-4H3
InChIKeyYOKUQXUXDHNYKC-UHFFFAOYSA-N
MW138.25 g/mol
LogP3.70
Rot. Bonds4

About 2,6-dimethylocta-1,5-diene

2,6-dimethylocta-1,5-diene (PubChem CID 54025904) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is 2,6-dimethylocta-1,5-diene.

Molecular Properties

Compound Name2,6-dimethylocta-1,5-diene
PubChem CID54025904
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name2,6-dimethylocta-1,5-diene
SMILESC=C(C)CCC=C(C)CC
InChIInChI=1S/C10H18/c1-5-10(4)8-6-7-9(2)3/h8H,2,5-7H2,1,3-4H3
InChIKeyYOKUQXUXDHNYKC-UHFFFAOYSA-N
XLogP3.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.70
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

(5E,9E)-2,6,10,14-tetramethylpentadeca-1,5,9,13-tetraene
CID 11758910
(5E,9E)-2,5,9-trimethyltrideca-1,5,9-triene
CID 145317472
(3E,7E)-4,8-dimethyldeca-3,7-dien-1-ol
CID 22749874
3,7,11-trimethyltrideca-2,6,10-triene
CID 54049885
8-methyl-4-methylidenedeca-1,7-diene
CID 152634439
(6E,10E,14E,18E)-2,6,11,15,19-pentamethylhenicosa-2,6,10,14,18-pentaene
CID 91751137
(4E)-4,8-dimethylnona-4,8-dien-3-one
CID 20501743
(E)-7-methylnon-6-en-3-one
CID 22749805
(5E,9E)-6,10-dimethyldodeca-5,9-dien-2-one
CID 5363460
(E)-5-methylhept-4-enoic acid
CID 83694352
(3E)-3,7-dimethylocta-3,7-dienenitrile
CID 6441547
3-ethyl-7-methylocta-3,7-dien-2-one
CID 54536933

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylocta-1,5-diene?
The IUPAC name of 2,6-dimethylocta-1,5-diene (CID 54025904) is 2,6-dimethylocta-1,5-diene.
What is the SMILES notation for 2,6-dimethylocta-1,5-diene?
The canonical SMILES for 2,6-dimethylocta-1,5-diene is C=C(C)CCC=C(C)CC.
What is the InChIKey of 2,6-dimethylocta-1,5-diene?
The InChIKey is YOKUQXUXDHNYKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-5-10(4)8-6-7-9(2)3/h8H,2,5-7H2,1,3-4H3.
What are the key properties of 2,6-dimethylocta-1,5-diene?
2,6-dimethylocta-1,5-diene has a molecular weight of 138.25 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylocta-1,5-diene is sourced from PubChem (CID 54025904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).