trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane

C20H13F3Si — CID 102177171

IUPACtrimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane
SMILESC[Si](C)(C)C#CC#CC#CC#CC#Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C20H13F3Si/c1-24(2,3)17-11-9-7-5-4-6-8-10-12-18-13-15-19(16-14-18)20(21,22)23/h13-16H,1-3H3
InChIKeyJMQBWNSERHNZOW-UHFFFAOYSA-N
MW338.40 g/mol
LogP3.95
Rot. Bonds

About trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane

trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane (PubChem CID 102177171) has the molecular formula C20H13F3Si and a molecular weight of 338.40 g/mol. Its IUPAC name is trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane.

Molecular Properties

Compound Nametrimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane
PubChem CID102177171
Molecular FormulaC20H13F3Si
Molecular Weight338.40 g/mol
Exact Mass338.07
IUPAC Nametrimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane
SMILESC[Si](C)(C)C#CC#CC#CC#CC#Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C20H13F3Si/c1-24(2,3)17-11-9-7-5-4-6-8-10-12-18-13-15-19(16-14-18)20(21,22)23/h13-16H,1-3H3
InChIKeyJMQBWNSERHNZOW-UHFFFAOYSA-N
XLogP3.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.40
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-(8-trimethylsilylocta-1,3,5,7-tetraynyl)benzonitrile
CID 132599654
1-(trifluoromethyl)-4-[2-[4-[2-[4-[2-[4-(trifluoromethyl)phenyl]ethynyl]phenyl]ethynyl]phenyl]ethynyl]benzene
CID 86099970
4-(4-trimethylsilylbuta-1,3-diynyl)benzoic acid
CID 141099093
1-(trifluoromethyl)-4-[4-[2-[4-(trifluoromethyl)phenyl]ethynyl]phenyl]benzene
CID 143875518
triethyl-[4-[4-(4-triethylsilylbuta-1,3-diynyl)phenyl]buta-1,3-diynyl]silane
CID 14965486
4-(4-butoxyphenyl)buta-1,3-diynyl-trimethylsilane
CID 10912597
trimethyl-[2-[4-(trifluoromethylsulfonyl)phenyl]ethynyl]silane
CID 121003520
ethane;1-(3-methylbut-1-ynyl)-4-(trifluoromethyl)benzene
CID 143067746
4-(4-hexylphenyl)buta-1,3-diynyl-trimethylsilane
CID 12032946
1-(trifluoromethyl)-4-[(E)-2-[4-[2-[4-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethynyl]phenyl]ethenyl]benzene
CID 59221378
1-pent-1-ynyl-4-(trifluoromethyl)benzene
CID 68880068
2-[4-(trifluoromethyl)phenyl]ethynesulfonamide
CID 174814107

Frequently Asked Questions

What is the IUPAC name of trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane?
The IUPAC name of trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane (CID 102177171) is trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane.
What is the SMILES notation for trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane?
The canonical SMILES for trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane is C[Si](C)(C)C#CC#CC#CC#CC#Cc1ccc(C(F)(F)F)cc1.
What is the InChIKey of trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane?
The InChIKey is JMQBWNSERHNZOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13F3Si/c1-24(2,3)17-11-9-7-5-4-6-8-10-12-18-13-15-19(16-14-18)20(21,22)23/h13-16H,1-3H3.
What are the key properties of trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane?
trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane has a molecular weight of 338.40 g/mol, XLogP of 3.95, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[10-[4-(trifluoromethyl)phenyl]deca-1,3,5,7,9-pentaynyl]silane is sourced from PubChem (CID 102177171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).