| CAS Number | 17921-68-5 |
| Catalog Number | AG0026US(AGN-PC-00H129) |
| Chemical Name | 4-(Trimethylsilyl)benzonitrile |
| IUPAC Name | 4-trimethylsilylbenzonitrile |
| InChI | InChI=1S/C10H13NSi/c1-12(2,3)10-6-4-9(8-11)5-7-10/h4-7H,1-3H3 |
| InChI Key | VLMZJZUVZAHCFT-UHFFFAOYSA-N |
| MDL Number | MFCD09039085 |
| Molecular Formula | C10H13NSi |
| Molecular Weight | 175.3024 |
| SMILES | [Si](C1(=CC=C(C#N)C=C1))(C)(C)C |
| Synonyms | 4-(TRIMETHYLSILYL)BENZONITRILE,
17921-68-5,
4-trimethylsilylbenzonitrile,
Benzonitrile,4-(trimethylsilyl)-,
(4-cyanophenyl)trimethylsilane,
4-Trimethlysilanylbenzonitrile,
SCHEMBL1161032,
CTK4D7219,
DTXSID80474028,
VLMZJZUVZAHCFT-UHFFFAOYSA-N,
Benzonitrile, 4-(trimethylsilyl)-,
KS-000022KK,
MFCD09039085,
AKOS006331715,
ZINC170018698,
AS-2951,
CID11829958,
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| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.306g/mol |
| Monoisotopic Mass | 175.082g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 23.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number