(6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene

C26H50 — CID 162079708

IUPAC(6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene
SMILESC=C(C)CCCC.CCC/C=C(\C)CCC=C(C)C.CCCC=C(C)C
InChIInChI=1S/C12H22.2C7H14/c1-5-6-9-12(4)10-7-8-11(2)3;2*1-4-5-6-7(2)3/h8-9H,5-7,10H2,1-4H3;6H,4-5H2,1-3H3;2,4-6H2,1,3H3/b12-9+;;
InChIKeyZCEDTMJURKXWSV-ANOGCNOSSA-N
MW362.69 g/mol
LogP9.98
Rot. Bonds10

About (6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene

(6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene (PubChem CID 162079708) has the molecular formula C26H50 and a molecular weight of 362.69 g/mol. Its IUPAC name is (6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene.

Molecular Properties

Compound Name(6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene
PubChem CID162079708
Molecular FormulaC26H50
Molecular Weight362.69 g/mol
Exact Mass362.39
IUPAC Name(6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene
SMILESC=C(C)CCCC.CCC/C=C(\C)CCC=C(C)C.CCCC=C(C)C
InChIInChI=1S/C12H22.2C7H14/c1-5-6-9-12(4)10-7-8-11(2)3;2*1-4-5-6-7(2)3/h8-9H,5-7,10H2,1-4H3;6H,4-5H2,1-3H3;2,4-6H2,1,3H3/b12-9+;;
InChIKeyZCEDTMJURKXWSV-ANOGCNOSSA-N
XLogP9.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.69
LogP ≤ 59.98
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)-2,5,9-trimethyltrideca-1,5,9-triene
CID 145317472
(5E,9E)-2,6,10,14-tetramethylpentadeca-1,5,9,13-tetraene
CID 11758910
2,8-dimethyldodeca-1,8-diene
CID 91581739
2,6-dimethyltetradeca-2,6-diene
CID 57189781
2,6-dimethyl-10-methylidenetrideca-2,6-diene
CID 141408483
(6E)-2,7-dimethyldeca-1,6-diene
CID 173073155
(6E,10E,15E)-2,6,10,16,20-pentamethylhenicosa-2,6,10,15,19-pentaene
CID 58662859
(14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 131954652
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 173324782
(6Z,10Z,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 24871318
(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
CID 173158415
2-methylhex-1-ene
CID 158402499

Frequently Asked Questions

What is the IUPAC name of (6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene?
The IUPAC name of (6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene (CID 162079708) is (6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene.
What is the SMILES notation for (6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene?
The canonical SMILES for (6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene is C=C(C)CCCC.CCC/C=C(\C)CCC=C(C)C.CCCC=C(C)C.
What is the InChIKey of (6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene?
The InChIKey is ZCEDTMJURKXWSV-ANOGCNOSSA-N. The full InChI is InChI=1S/C12H22.2C7H14/c1-5-6-9-12(4)10-7-8-11(2)3;2*1-4-5-6-7(2)3/h8-9H,5-7,10H2,1-4H3;6H,4-5H2,1-3H3;2,4-6H2,1,3H3/b12-9+;;.
What are the key properties of (6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene?
(6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene has a molecular weight of 362.69 g/mol, XLogP of 9.98, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E)-2,6-dimethyldeca-2,6-diene;2-methylhex-1-ene;2-methylhex-2-ene is sourced from PubChem (CID 162079708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).