7-methylundeca-1,2,3,4,5,6-hexaene

C12H14 — CID 59116233

IUPAC7-methylundeca-1,2,3,4,5,6-hexaene
SMILESC=C=C=C=C=C=C(C)CCCC
InChIInChI=1S/C12H14/c1-4-6-8-9-11-12(3)10-7-5-2/h1,5,7,10H2,2-3H3
InChIKeyUGUMDQOBAOTJFD-UHFFFAOYSA-N
MW158.24 g/mol
LogP3.53
Rot. Bonds3

About 7-methylundeca-1,2,3,4,5,6-hexaene

7-methylundeca-1,2,3,4,5,6-hexaene (PubChem CID 59116233) has the molecular formula C12H14 and a molecular weight of 158.24 g/mol. Its IUPAC name is 7-methylundeca-1,2,3,4,5,6-hexaene.

Molecular Properties

Compound Name7-methylundeca-1,2,3,4,5,6-hexaene
PubChem CID59116233
Molecular FormulaC12H14
Molecular Weight158.24 g/mol
Exact Mass158.11
IUPAC Name7-methylundeca-1,2,3,4,5,6-hexaene
SMILESC=C=C=C=C=C=C(C)CCCC
InChIInChI=1S/C12H14/c1-4-6-8-9-11-12(3)10-7-5-2/h1,5,7,10H2,2-3H3
InChIKeyUGUMDQOBAOTJFD-UHFFFAOYSA-N
XLogP3.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7-methylundeca-1,2,3,4,5,6-hexaene?
The IUPAC name of 7-methylundeca-1,2,3,4,5,6-hexaene (CID 59116233) is 7-methylundeca-1,2,3,4,5,6-hexaene.
What is the SMILES notation for 7-methylundeca-1,2,3,4,5,6-hexaene?
The canonical SMILES for 7-methylundeca-1,2,3,4,5,6-hexaene is C=C=C=C=C=C=C(C)CCCC.
What is the InChIKey of 7-methylundeca-1,2,3,4,5,6-hexaene?
The InChIKey is UGUMDQOBAOTJFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14/c1-4-6-8-9-11-12(3)10-7-5-2/h1,5,7,10H2,2-3H3.
What are the key properties of 7-methylundeca-1,2,3,4,5,6-hexaene?
7-methylundeca-1,2,3,4,5,6-hexaene has a molecular weight of 158.24 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylundeca-1,2,3,4,5,6-hexaene is sourced from PubChem (CID 59116233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).