| CAS Number | 351360-83-3 |
| Catalog Number | AG01EA7P |
| Chemical Name | tert-butyl N-(3-phenylpyrrolidin-3-yl)carbamate |
| IUPAC Name | tert-butyl N-(3-phenylpyrrolidin-3-yl)carbamate |
| InChI | InChI=1S/C15H22N2O2/c1-14(2,3)19-13(18)17-15(9-10-16-11-15)12-7-5-4-6-8-12/h4-8,16H,9-11H2,1-3H3,(H,17,18) |
| InChI Key | QELMUWDFAGEENM-UHFFFAOYSA-N |
| MDL Number | MFCD31615877 |
| Molecular Formula | C15H22N2O2 |
| Molecular Weight | 262.3474 |
| SMILES | CC(OC(NC1(C2=CC=CC=C2)CNCC1)=O)(C)C |
| Synonyms | SCHEMBL1034088,
QELMUWDFAGEENM-UHFFFAOYSA-N,
DB-096997,
(3-Phenylpyrrolin-3-yl)carbamic acid tert-butyl ester,
(3-Phenylpyrrolidin-3-yl)carbamic acid tert-butyl ester,
351360-83-3,
|
| Complexity | 319 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.168128g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 262.35g/mol |
| Monoisotopic Mass | 262.168128g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 50.4Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number