(6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene

C12H18 — CID 142247806

IUPAC(6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene
SMILESC=CCC(=C)C/C=C(C)/C=C\C
InChIInChI=1S/C12H18/c1-5-7-11(3)9-10-12(4)8-6-2/h5-6,8,10H,1,3,7,9H2,2,4H3/b8-6-,12-10+
InChIKeyLLLOOQHOLGYBLC-DEOFSOSHSA-N
MW162.28 g/mol
LogP4.03
Rot. Bonds5

About (6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene

(6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene (PubChem CID 142247806) has the molecular formula C12H18 and a molecular weight of 162.28 g/mol. Its IUPAC name is (6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene.

Molecular Properties

Compound Name(6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene
PubChem CID142247806
Molecular FormulaC12H18
Molecular Weight162.28 g/mol
Exact Mass162.14
IUPAC Name(6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene
SMILESC=CCC(=C)C/C=C(C)/C=C\C
InChIInChI=1S/C12H18/c1-5-7-11(3)9-10-12(4)8-6-2/h5-6,8,10H,1,3,7,9H2,2,4H3/b8-6-,12-10+
InChIKeyLLLOOQHOLGYBLC-DEOFSOSHSA-N
XLogP4.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene?
The IUPAC name of (6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene (CID 142247806) is (6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene.
What is the SMILES notation for (6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene?
The canonical SMILES for (6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene is C=CCC(=C)C/C=C(C)/C=C\C.
What is the InChIKey of (6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene?
The InChIKey is LLLOOQHOLGYBLC-DEOFSOSHSA-N. The full InChI is InChI=1S/C12H18/c1-5-7-11(3)9-10-12(4)8-6-2/h5-6,8,10H,1,3,7,9H2,2,4H3/b8-6-,12-10+.
What are the key properties of (6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene?
(6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene has a molecular weight of 162.28 g/mol, XLogP of 4.03, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,8Z)-7-methyl-4-methylidenedeca-1,6,8-triene is sourced from PubChem (CID 142247806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).