(4Z)-6,10-dimethyldodeca-4,6-dien-1-yne

C14H22 — CID 144531228

IUPAC(4Z)-6,10-dimethyldodeca-4,6-dien-1-yne
SMILESC#CC/C=C\C(C)=CCCC(C)CC
InChIInChI=1S/C14H22/c1-5-7-8-10-14(4)12-9-11-13(3)6-2/h1,8,10,12-13H,6-7,9,11H2,2-4H3/b10-8-,14-12?
InChIKeyVMERZXIJWRTWCJ-AHSZUYRUSA-N
MW190.33 g/mol
LogP4.34
Rot. Bonds6

About (4Z)-6,10-dimethyldodeca-4,6-dien-1-yne

(4Z)-6,10-dimethyldodeca-4,6-dien-1-yne (PubChem CID 144531228) has the molecular formula C14H22 and a molecular weight of 190.33 g/mol. Its IUPAC name is (4Z)-6,10-dimethyldodeca-4,6-dien-1-yne.

Molecular Properties

Compound Name(4Z)-6,10-dimethyldodeca-4,6-dien-1-yne
PubChem CID144531228
Molecular FormulaC14H22
Molecular Weight190.33 g/mol
Exact Mass190.17
IUPAC Name(4Z)-6,10-dimethyldodeca-4,6-dien-1-yne
SMILESC#CC/C=C\C(C)=CCCC(C)CC
InChIInChI=1S/C14H22/c1-5-7-8-10-14(4)12-9-11-13(3)6-2/h1,8,10,12-13H,6-7,9,11H2,2-4H3/b10-8-,14-12?
InChIKeyVMERZXIJWRTWCJ-AHSZUYRUSA-N
XLogP4.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.33
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(4Z,6Z)-6-methylnona-4,6-dien-1-yne
CID 143682413
(2E,4E,8S)-3,8,12-trimethyltrideca-2,4,11-triene
CID 134982878
(2Z,4Z,7S)-3,7,11-trimethyldodeca-2,4,10-triene
CID 98562862
(2Z,4E,7R)-3,7,11-trimethyldodeca-2,4,10-triene
CID 15276139
(3Z,5Z)-5-methylnona-3,5-dienenitrile
CID 143786949
(4E,6E)-2,6,10-trimethyltrideca-2,4,6-triene
CID 173229082
2,7-dimethylnona-2,3-diene
CID 123700198
6,10-dimethylundec-9-en-1-yne
CID 175139097
bis((6S)-2,6-dimethyloct-2-ene);(2S,3R,4S,5R)-2,3,4,5-tetrahydroxyhexanedioic acid
CID 158174482
5-methyl-1-(5-methylhept-1-enoxy)hept-1-ene
CID 139882070
2,6-dimethyl-10-(trideuteriomethyl)dodec-2-ene
CID 11252860
(4E,8E)-5,9,13,17-tetramethyloctadeca-4,8,16-trien-1-yne
CID 140820993

Frequently Asked Questions

What is the IUPAC name of (4Z)-6,10-dimethyldodeca-4,6-dien-1-yne?
The IUPAC name of (4Z)-6,10-dimethyldodeca-4,6-dien-1-yne (CID 144531228) is (4Z)-6,10-dimethyldodeca-4,6-dien-1-yne.
What is the SMILES notation for (4Z)-6,10-dimethyldodeca-4,6-dien-1-yne?
The canonical SMILES for (4Z)-6,10-dimethyldodeca-4,6-dien-1-yne is C#CC/C=C\C(C)=CCCC(C)CC.
What is the InChIKey of (4Z)-6,10-dimethyldodeca-4,6-dien-1-yne?
The InChIKey is VMERZXIJWRTWCJ-AHSZUYRUSA-N. The full InChI is InChI=1S/C14H22/c1-5-7-8-10-14(4)12-9-11-13(3)6-2/h1,8,10,12-13H,6-7,9,11H2,2-4H3/b10-8-,14-12?.
What are the key properties of (4Z)-6,10-dimethyldodeca-4,6-dien-1-yne?
(4Z)-6,10-dimethyldodeca-4,6-dien-1-yne has a molecular weight of 190.33 g/mol, XLogP of 4.34, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-6,10-dimethyldodeca-4,6-dien-1-yne is sourced from PubChem (CID 144531228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).