ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum

C20H29F3N2OPtSi2 — CID 87352049

IUPACethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum
SMILESC=C[Si](C)(C)O[Si](C)(C)C=C.Cn1ccn(Cc2ccc(C(F)(F)F)cc2)c1=[Pt]
InChIInChI=1S/C12H11F3N2.C8H18OSi2.Pt/c1-16-6-7-17(9-16)8-10-2-4-11(5-3-10)12(13,14)15;1-7-10(3,4)9-11(5,6)8-2;/h2-7H,8H2,1H3;7-8H,1-2H2,3-6H3;
InChIKeyOTMZNOWTXYIMEL-UHFFFAOYSA-N
MW621.71 g/mol
LogP5.84
Rot. Bonds6

About ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum

ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum (PubChem CID 87352049) has the molecular formula C20H29F3N2OPtSi2 and a molecular weight of 621.71 g/mol. Its IUPAC name is ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum.

Molecular Properties

Compound Nameethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum
PubChem CID87352049
Molecular FormulaC20H29F3N2OPtSi2
Molecular Weight621.71 g/mol
Exact Mass621.14
IUPAC Nameethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum
SMILESC=C[Si](C)(C)O[Si](C)(C)C=C.Cn1ccn(Cc2ccc(C(F)(F)F)cc2)c1=[Pt]
InChIInChI=1S/C12H11F3N2.C8H18OSi2.Pt/c1-16-6-7-17(9-16)8-10-2-4-11(5-3-10)12(13,14)15;1-7-10(3,4)9-11(5,6)8-2;/h2-7H,8H2,1H3;7-8H,1-2H2,3-6H3;
InChIKeyOTMZNOWTXYIMEL-UHFFFAOYSA-N
XLogP5.84
TPSA19.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500621.71
LogP ≤ 55.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum?
The IUPAC name of ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum (CID 87352049) is ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum.
What is the SMILES notation for ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum?
The canonical SMILES for ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum is C=C[Si](C)(C)O[Si](C)(C)C=C.Cn1ccn(Cc2ccc(C(F)(F)F)cc2)c1=[Pt].
What is the InChIKey of ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum?
The InChIKey is OTMZNOWTXYIMEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N2.C8H18OSi2.Pt/c1-16-6-7-17(9-16)8-10-2-4-11(5-3-10)12(13,14)15;1-7-10(3,4)9-11(5,6)8-2;/h2-7H,8H2,1H3;7-8H,1-2H2,3-6H3;.
What are the key properties of ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum?
ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum has a molecular weight of 621.71 g/mol, XLogP of 5.84, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-[ethenyl(dimethyl)silyl]oxy-dimethylsilane;[1-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-ylidene]platinum is sourced from PubChem (CID 87352049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).