| CAS Number | 1383682-59-4 |
| Catalog Number | AG00A00P(AGN-PC-0WNGNF) |
| Chemical Name | tert-Butyl 4-(4-amino-3-methylphenyl)piperidine-1-carboxylate |
| IUPAC Name | tert-butyl 4-(4-amino-3-methylphenyl)piperidine-1-carboxylate |
| InChI | InChI=1S/C17H26N2O2/c1-12-11-14(5-6-15(12)18)13-7-9-19(10-8-13)16(20)21-17(2,3)4/h5-6,11,13H,7-10,18H2,1-4H3 |
| InChI Key | FYWQDSKSFFKCHX-UHFFFAOYSA-N |
| MDL Number | MFCD30294365 |
| Molecular Formula | C17H26N2O2 |
| Molecular Weight | 290.4005 |
| SMILES | O=C(N1CCC(CC1)c1ccc(c(c1)C)N)OC(C)(C)C |
| Synonyms | tert-butyl 4-(4-amino-3-methylphenyl)piperidine-1-carboxylate,
1383682-59-4,
SCHEMBL12479918,
FYWQDSKSFFKCHX-UHFFFAOYSA-N,
MFCD30294365,
ZINC148002662,
CS-W018395,
KS-00000U87,
AK680455,
DS-20058,
t-Butyl 4-(4-amino-3-methylphenyl)piperidine-1-carboxylate,
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| Complexity | 356 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 290.199g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 290.407g/mol |
| Monoisotopic Mass | 290.199g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number