| CAS Number | 870703-77-8 |
| Catalog Number | AG00H0WP(AGN-PC-00UQQE) |
| Chemical Name | 2-(4-Boc-aminopiperidin-1-yl)-2-(furan-2-yl)acetic acid |
| IUPAC Name | 2-(furan-2-yl)-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]acetic acid |
| InChI | InChI=1S/C16H24N2O5/c1-16(2,3)23-15(21)17-11-6-8-18(9-7-11)13(14(19)20)12-5-4-10-22-12/h4-5,10-11,13H,6-9H2,1-3H3,(H,17,21)(H,19,20) |
| InChI Key | YPMFFOGSMOXXLA-UHFFFAOYSA-N |
| MDL Number | MFCD04115149 |
| Molecular Formula | C16H24N2O5 |
| Molecular Weight | 324.3722 |
| SMILES | O=C(OC(C)(C)C)NC1CCN(CC1)C(c1ccco1)C(=O)O |
| Synonyms | 870703-77-8,
2-(4-((tert-Butoxycarbonyl)amino)piperidin-1-yl)-2-(furan-2-yl)acetic acid,
2-(4-Boc-aminopiperidin-1-yl)-2-(furan-2-yl)acetic acid,
DTXSID90584662,
4802AH,
AKOS024258455,
KS-000018D6,
AX8291517,
2-(4-Boc-aminopiperidin-1-yl)-2-(furan-,
A-7569,
2-(4-Boc-aminopiperidin-1-yl)-2-(furan-2-yl)acetic acid, 97%,
{4-[(tert-Butoxycarbonyl)amino]piperidin-1-yl}(furan-2-yl)acetic acid,
2-(4-N-(tert-Butoxycarbonyl)aminopiperidin-1-yl)-2-(furan-2-yl)acetic acid,
2-(furan-2-yl)-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]acetic acid,
C16H24N2O5,
2- -2-(FURAN-&,
(4-Boc-amino-piperidin-1-yl)-furan-2-yl-acetic acid,
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| Complexity | 427 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 324.169g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 324.377g/mol |
| Monoisotopic Mass | 324.169g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 92A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number