| CAS Number | 1160248-34-9 |
| Catalog Number | AG00HD91(AGN-PC-0WG4V4) |
| Chemical Name | Benzyl 3-(1-(tert-butoxycarbonyl)piperidin-3-yl)indoline-1-carboxylate |
| IUPAC Name | benzyl 3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-2,3-dihydroindole-1-carboxylate |
| InChI | InChI=1S/C26H32N2O4/c1-26(2,3)32-24(29)27-15-9-12-20(16-27)22-17-28(23-14-8-7-13-21(22)23)25(30)31-18-19-10-5-4-6-11-19/h4-8,10-11,13-14,20,22H,9,12,15-18H2,1-3H3 |
| InChI Key | CDYLQCIGJAGOQL-UHFFFAOYSA-N |
| MDL Number | MFCD12198803 |
| Molecular Formula | C26H32N2O4 |
| Molecular Weight | 436.5433 |
| SMILES | CC(C)(C)OC(=O)N1CCCC(C1)C1CN(C(=O)OCc2ccccc2)c2ccccc12 |
| Synonyms | 1160248-34-9,
Benzyl 3-(1-(tert-butoxycarbonyl)piperidin-3-yl)indoline-1-carboxylate,
MFCD12198803,
AM804664,
CS-0038521,
Benzyl 3-(1-(t-butoxycarbonyl)piperidin-3-yl)indoline-1-carboxylate,
benzyl3-(1-(tert-butoxycarbonyl)piperidin-3-yl)indoline-1-carboxylate,
Benzyl 3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-2,3-dihydroindole-1-carboxylate,
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| Complexity | 655 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 436.236g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 32 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 436.552g/mol |
| Monoisotopic Mass | 436.236g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 59.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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