3-tert-butyl-6-methyldeca-2,4,6,7-tetraene

C15H24 — CID 123641549

IUPAC3-tert-butyl-6-methyldeca-2,4,6,7-tetraene
SMILESCC=C(C=CC(C)=C=CCC)C(C)(C)C
InChIInChI=1S/C15H24/c1-7-9-10-13(3)11-12-14(8-2)15(4,5)6/h8-9,11-12H,7H2,1-6H3
InChIKeyYTPLHCHWWLVFTN-UHFFFAOYSA-N
MW204.36 g/mol
LogP5.05
Rot. Bonds3

About 3-tert-butyl-6-methyldeca-2,4,6,7-tetraene

3-tert-butyl-6-methyldeca-2,4,6,7-tetraene (PubChem CID 123641549) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 3-tert-butyl-6-methyldeca-2,4,6,7-tetraene.

Molecular Properties

Compound Name3-tert-butyl-6-methyldeca-2,4,6,7-tetraene
PubChem CID123641549
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name3-tert-butyl-6-methyldeca-2,4,6,7-tetraene
SMILESCC=C(C=CC(C)=C=CCC)C(C)(C)C
InChIInChI=1S/C15H24/c1-7-9-10-13(3)11-12-14(8-2)15(4,5)6/h8-9,11-12H,7H2,1-6H3
InChIKeyYTPLHCHWWLVFTN-UHFFFAOYSA-N
XLogP5.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500204.36
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(2E,4Z)-3-tert-butyl-5-methylhepta-2,4-diene
CID 177352522
(Z,3E)-3-ethylidene-2-methylhept-4-en-2-amine
CID 145473647
(2Z,4Z,6E)-6-tert-butylocta-2,4,6-trien-2-amine
CID 126590897
(1Z,3Z,5E)-5-tert-butylhepta-1,3,5-trien-1-amine
CID 138751856
2,2-dimethylbutane;2-methylbut-2-ene
CID 142603024
(1Z,3E)-3-tert-butylhexa-1,3-dien-1-amine
CID 134200134
(2Z,4E)-4-tert-butyl-N-methylhexa-2,4-dien-1-imine
CID 167182965
(E)-3-ethyl-4,4-dimethylpent-2-ene
CID 5369078
4,8,8-trimethylnona-3,5-diene
CID 123895816
(3E)-5-tert-butyl-2-methylhepta-1,3,5-trien-3-amine
CID 143941928
(Z,3E)-6-butan-2-ylidene-3-ethylidene-2,8-dimethyldec-4-en-2-ol
CID 163390649
[(2Z,4E)-4-tert-butylhexa-2,4-dienyl]urea
CID 171540295

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-6-methyldeca-2,4,6,7-tetraene?
The IUPAC name of 3-tert-butyl-6-methyldeca-2,4,6,7-tetraene (CID 123641549) is 3-tert-butyl-6-methyldeca-2,4,6,7-tetraene.
What is the SMILES notation for 3-tert-butyl-6-methyldeca-2,4,6,7-tetraene?
The canonical SMILES for 3-tert-butyl-6-methyldeca-2,4,6,7-tetraene is CC=C(C=CC(C)=C=CCC)C(C)(C)C.
What is the InChIKey of 3-tert-butyl-6-methyldeca-2,4,6,7-tetraene?
The InChIKey is YTPLHCHWWLVFTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-7-9-10-13(3)11-12-14(8-2)15(4,5)6/h8-9,11-12H,7H2,1-6H3.
What are the key properties of 3-tert-butyl-6-methyldeca-2,4,6,7-tetraene?
3-tert-butyl-6-methyldeca-2,4,6,7-tetraene has a molecular weight of 204.36 g/mol, XLogP of 5.05, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-6-methyldeca-2,4,6,7-tetraene is sourced from PubChem (CID 123641549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).