trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane

C21H36Si — CID 73095183

IUPACtrimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane
SMILESCC(C)=CCCC(C)=CCCC(C)=CCCC#C[Si](C)(C)C
InChIInChI=1S/C21H36Si/c1-19(2)13-11-15-21(4)17-12-16-20(3)14-9-8-10-18-22(5,6)7/h13-14,17H,8-9,11-12,15-16H2,1-7H3
InChIKeyWWILOFJTMIMTGR-UHFFFAOYSA-N
MW316.61 g/mol
LogP7.07
Rot. Bonds8

About trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane

trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane (PubChem CID 73095183) has the molecular formula C21H36Si and a molecular weight of 316.61 g/mol. Its IUPAC name is trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane.

Molecular Properties

Compound Nametrimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane
PubChem CID73095183
Molecular FormulaC21H36Si
Molecular Weight316.61 g/mol
Exact Mass316.26
IUPAC Nametrimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane
SMILESCC(C)=CCCC(C)=CCCC(C)=CCCC#C[Si](C)(C)C
InChIInChI=1S/C21H36Si/c1-19(2)13-11-15-21(4)17-12-16-20(3)14-9-8-10-18-22(5,6)7/h13-14,17H,8-9,11-12,15-16H2,1-7H3
InChIKeyWWILOFJTMIMTGR-UHFFFAOYSA-N
XLogP7.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.61
LogP ≤ 57.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

(6E)-7,11-dimethyldodeca-6,10-dien-2-yn-1-ol
CID 11830599
methyl (E)-4-methyl-9-trimethylsilylnon-4-en-8-ynoate
CID 88784591
(9E)-10,14-dimethylpentadeca-9,13-dien-5-yn-2-one
CID 10060501
trimethyl-[(5E,9E,13E,17E)-6,10,14,18,22-pentamethyl-8-(4-methylphenyl)sulfonyltricosa-5,9,13,17,21-pentaen-1-ynyl]silane
CID 10995646
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 173324782
(6Z,10Z,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 24871318
(14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 131954652
(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
CID 173158415
carbon dioxide;(6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 174737986
(6E,10E,15E)-2,6,10,16,20-pentamethylhenicosa-2,6,10,15,19-pentaene
CID 58662859
(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trien-1-ol
CID 5362831
(2E,6Z)-1-chloro-3,7,11-trimethyldodeca-2,6,10-triene
CID 10752589

Frequently Asked Questions

What is the IUPAC name of trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane?
The IUPAC name of trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane (CID 73095183) is trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane.
What is the SMILES notation for trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane?
The canonical SMILES for trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane is CC(C)=CCCC(C)=CCCC(C)=CCCC#C[Si](C)(C)C.
What is the InChIKey of trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane?
The InChIKey is WWILOFJTMIMTGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H36Si/c1-19(2)13-11-15-21(4)17-12-16-20(3)14-9-8-10-18-22(5,6)7/h13-14,17H,8-9,11-12,15-16H2,1-7H3.
What are the key properties of trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane?
trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane has a molecular weight of 316.61 g/mol, XLogP of 7.07, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(6,10,14-trimethylpentadeca-5,9,13-trien-1-ynyl)silane is sourced from PubChem (CID 73095183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).