(3Z,5Z)-10-methylundeca-1,3,5-triene

C12H20 — CID 172592862

IUPAC(3Z,5Z)-10-methylundeca-1,3,5-triene
SMILESC=C/C=C\C=C/CCCC(C)C
InChIInChI=1S/C12H20/c1-4-5-6-7-8-9-10-11-12(2)3/h4-8,12H,1,9-11H2,2-3H3/b6-5-,8-7-
InChIKeyGOOGWHBITRIUJD-ISTTXYCBSA-N
MW164.29 g/mol
LogP4.11
Rot. Bonds6

About (3Z,5Z)-10-methylundeca-1,3,5-triene

(3Z,5Z)-10-methylundeca-1,3,5-triene (PubChem CID 172592862) has the molecular formula C12H20 and a molecular weight of 164.29 g/mol. Its IUPAC name is (3Z,5Z)-10-methylundeca-1,3,5-triene.

Molecular Properties

Compound Name(3Z,5Z)-10-methylundeca-1,3,5-triene
PubChem CID172592862
Molecular FormulaC12H20
Molecular Weight164.29 g/mol
Exact Mass164.16
IUPAC Name(3Z,5Z)-10-methylundeca-1,3,5-triene
SMILESC=C/C=C\C=C/CCCC(C)C
InChIInChI=1S/C12H20/c1-4-5-6-7-8-9-10-11-12(2)3/h4-8,12H,1,9-11H2,2-3H3/b6-5-,8-7-
InChIKeyGOOGWHBITRIUJD-ISTTXYCBSA-N
XLogP4.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.29
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

11-methyldodeca-1,3-diene
CID 154156925
(Z)-N-ethenyl-7-methyloct-2-en-1-imine
CID 170379878
triaconta-1,3,5,7,9,11,13,15,17,19,21,23,25-tridecaene
CID 91195237
tert-butyl-dimethyl-[(2R,6E,8E)-undeca-6,8,10-trien-2-yl]oxysilane
CID 11004320
(3E,5E,7E,9E,11E,13E,15E)-triaconta-1,3,5,7,9,11,13,15-octaene
CID 173021038
octadeca-1,3,5,7,9,11-hexaene
CID 90906281
tricosa-1,3,5,7-tetraene
CID 90704431
henicosa-1,3,5,7,9,11,13-heptaene
CID 90898845
hexacosa-1,3,5,7,9,11,13,15,17-nonaene
CID 91421045
(3E,5E,7E,9E,11E,13E)-tricosa-1,3,5,7,9,11,13-heptaene
CID 173020960
hecta-1,3,5,7,9,11,13,15,17,19-decaene
CID 173395996
(E)-2,12-dimethyltridec-6-ene
CID 176630963

Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-10-methylundeca-1,3,5-triene?
The IUPAC name of (3Z,5Z)-10-methylundeca-1,3,5-triene (CID 172592862) is (3Z,5Z)-10-methylundeca-1,3,5-triene.
What is the SMILES notation for (3Z,5Z)-10-methylundeca-1,3,5-triene?
The canonical SMILES for (3Z,5Z)-10-methylundeca-1,3,5-triene is C=C/C=C\C=C/CCCC(C)C.
What is the InChIKey of (3Z,5Z)-10-methylundeca-1,3,5-triene?
The InChIKey is GOOGWHBITRIUJD-ISTTXYCBSA-N. The full InChI is InChI=1S/C12H20/c1-4-5-6-7-8-9-10-11-12(2)3/h4-8,12H,1,9-11H2,2-3H3/b6-5-,8-7-.
What are the key properties of (3Z,5Z)-10-methylundeca-1,3,5-triene?
(3Z,5Z)-10-methylundeca-1,3,5-triene has a molecular weight of 164.29 g/mol, XLogP of 4.11, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-10-methylundeca-1,3,5-triene is sourced from PubChem (CID 172592862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).