| CAS Number | 317842-68-5 |
| Catalog Number | AG01C53R(AGN-PC-0O8V3Q) |
| Chemical Name | tert-butyl N-{4-[2-(trimethylsilyl)ethynyl]phenyl}carbamate |
| IUPAC Name | tert-butyl N-[4-(2-trimethylsilylethynyl)phenyl]carbamate |
| InChI | InChI=1S/C16H23NO2Si/c1-16(2,3)19-15(18)17-14-9-7-13(8-10-14)11-12-20(4,5)6/h7-10H,1-6H3,(H,17,18) |
| InChI Key | CSUMRYKOCILLJU-UHFFFAOYSA-N |
| MDL Number | MFCD24468484 |
| Molecular Formula | C16H23NO2Si |
| Molecular Weight | 289.4448 |
| SMILES | CC(OC(NC1=CC=C(C#C[Si](C)(C)C)C=C1)=O)(C)C |
| Synonyms | tert-butyl N-{4-[2-(trimethylsilyl)ethynyl]phenyl}carbamate,
317842-68-5,
ZINC215509738,
N-(tert-Butyloxycarbonyl)-4-[(trimethylsilyl)ethynyl]aniline,
|
| Complexity | 398 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 289.15g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 289.45g/mol |
| Monoisotopic Mass | 289.15g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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