(2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene

C13H20 — CID 14656044

IUPAC(2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene
SMILESC/C=C/C(C)=C/C(C)=C/C(C)=C/C
InChIInChI=1S/C13H20/c1-6-8-12(4)10-13(5)9-11(3)7-2/h6-10H,1-5H3/b8-6+,11-7+,12-10+,13-9+
InChIKeyRRPFGKUHEMWGSW-RYNMLCPOSA-N
MW176.30 g/mol
LogP4.42
Rot. Bonds3

About (2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene

(2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene (PubChem CID 14656044) has the molecular formula C13H20 and a molecular weight of 176.30 g/mol. Its IUPAC name is (2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene.

Molecular Properties

Compound Name(2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene
PubChem CID14656044
Molecular FormulaC13H20
Molecular Weight176.30 g/mol
Exact Mass176.16
IUPAC Name(2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene
SMILESC/C=C/C(C)=C/C(C)=C/C(C)=C/C
InChIInChI=1S/C13H20/c1-6-8-12(4)10-13(5)9-11(3)7-2/h6-10H,1-5H3/b8-6+,11-7+,12-10+,13-9+
InChIKeyRRPFGKUHEMWGSW-RYNMLCPOSA-N
XLogP4.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene?
The IUPAC name of (2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene (CID 14656044) is (2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene.
What is the SMILES notation for (2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene?
The canonical SMILES for (2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene is C/C=C/C(C)=C/C(C)=C/C(C)=C/C.
What is the InChIKey of (2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene?
The InChIKey is RRPFGKUHEMWGSW-RYNMLCPOSA-N. The full InChI is InChI=1S/C13H20/c1-6-8-12(4)10-13(5)9-11(3)7-2/h6-10H,1-5H3/b8-6+,11-7+,12-10+,13-9+.
What are the key properties of (2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene?
(2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene has a molecular weight of 176.30 g/mol, XLogP of 4.42, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E,6E,8E)-3,5,7-trimethyldeca-2,4,6,8-tetraene is sourced from PubChem (CID 14656044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).