| CAS Number | 1228666-21-4 |
| Catalog Number | AG00HH3T(AGN-PC-0WAO4A) |
| Chemical Name | 6-(3-((Tert-butyldimethylsilyloxy)methyl)-pyrrolidin-1-YL)-2-fluoronicotinic acid |
| IUPAC Name | 6-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrrolidin-1-yl]-2-fluoropyridine-3-carboxylic acid |
| InChI | InChI=1S/C17H27FN2O3Si/c1-17(2,3)24(4,5)23-11-12-8-9-20(10-12)14-7-6-13(16(21)22)15(18)19-14/h6-7,12H,8-11H2,1-5H3,(H,21,22) |
| InChI Key | CFUCDNWBSUCSFQ-UHFFFAOYSA-N |
| MDL Number | MFCD15530309 |
| Molecular Formula | C17H27FN2O3Si |
| Molecular Weight | 354.4918 |
| SMILES | OC(=O)c1ccc(nc1F)N1CCC(C1)CO[Si](C(C)(C)C)(C)C |
| Synonyms | 1228666-21-4,
6-(3-((TERT-BUTYLDIMETHYLSILYLOXY)METHYL)-PYRROLIDIN-1-YL)-2-FLUORONICOTINIC ACID,
6-(3-((tert-Butyldimethylsilyloxy)methyl)pyrrolidin-1-yl)-2-fluoronicotinic acid,
6-(3-(((tert-Butyldimethylsilyl)oxy)methyl)pyrrolidin-1-yl)-2-fluoronicotinic acid,
AC1Q1LJP,
C17H27FN2O3Si,
CTK7I8240,
DTXSID00673617,
2642AD,
MFCD15530309,
AKOS015837857,
DB-062110,
TR-071313,
FT-0702420,
6-[3-(tert-Butyldimethylsilyloxymethyl)pyrrolidin-1-yl]-2-fluoronicotinic acid,
6-(3-((tert-Butyldimethylsilyloxy)methyl)pyrrolidin-1-yl)-2-fluoronicotinic acid, AldrichCPR,
6-(3-{[(tert-butyldimethylsilyl)oxy]methyl}pyrrolidin-1-yl)-2-fluoropyridine-3-carboxylic acid,
6-[3-({[tert-Butyl(dimethyl)silyl]oxy}methyl)pyrrolidin-1-yl]-2-fluoropyridine-3-carboxylic acid,
|
| Complexity | 456 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 354.177g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 354.497g/mol |
| Monoisotopic Mass | 354.177g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 62.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number