(2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene

C15H24 — CID 142378055

IUPAC(2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene
SMILESC=C(C=C(C)C)CC/C=C/CC/C=C/C
InChIInChI=1S/C15H24/c1-5-6-7-8-9-10-11-12-15(4)13-14(2)3/h5-6,9-10,13H,4,7-8,11-12H2,1-3H3/b6-5+,10-9+
InChIKeyVIQCORSZMGARBS-QPHGKBKNSA-N
MW204.36 g/mol
LogP5.20
Rot. Bonds7

About (2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene

(2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene (PubChem CID 142378055) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is (2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene.

Molecular Properties

Compound Name(2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene
PubChem CID142378055
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name(2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene
SMILESC=C(C=C(C)C)CC/C=C/CC/C=C/C
InChIInChI=1S/C15H24/c1-5-6-7-8-9-10-11-12-15(4)13-14(2)3/h5-6,9-10,13H,4,7-8,11-12H2,1-3H3/b6-5+,10-9+
InChIKeyVIQCORSZMGARBS-QPHGKBKNSA-N
XLogP5.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500204.36
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 12503721
hexatriaconta-2,6,10,14,18,22,26,30,34-nonaene
CID 154144745
(2E,6E,10E,14E,18E,22E)-tetracosa-2,6,10,14,18,22-hexaene
CID 57417215
ethane;(5E)-2-methylhepta-1,5-diene
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(5Z)-hepta-1,5-dien-2-ol
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8-methylidenedeca-2,6-diene
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(4E)-2-methylhexa-1,4-diene
CID 5367524
(2E,6E,10E,14E)-hexadeca-2,6,10,14-tetraen-1-ol
CID 21397771
3-methyldodeca-2,6,10-trien-1-ol
CID 57126192
(4E,8E)-2-methyldeca-2,4,8-triene
CID 173142496
(7Z)-N,2-dimethyl-5-methylidenenona-2,7-dien-4-imine
CID 143316591
icosa-2,10,18-triene
CID 74063823

Frequently Asked Questions

What is the IUPAC name of (2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene?
The IUPAC name of (2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene (CID 142378055) is (2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene.
What is the SMILES notation for (2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene?
The canonical SMILES for (2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene is C=C(C=C(C)C)CC/C=C/CC/C=C/C.
What is the InChIKey of (2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene?
The InChIKey is VIQCORSZMGARBS-QPHGKBKNSA-N. The full InChI is InChI=1S/C15H24/c1-5-6-7-8-9-10-11-12-15(4)13-14(2)3/h5-6,9-10,13H,4,7-8,11-12H2,1-3H3/b6-5+,10-9+.
What are the key properties of (2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene?
(2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene has a molecular weight of 204.36 g/mol, XLogP of 5.20, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,6E)-12-methyl-10-methylidenetrideca-2,6,11-triene is sourced from PubChem (CID 142378055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).