| CAS Number | 1820574-83-1 |
| Catalog Number | AG00J2TE(AGN-PC-0WRAQW) |
| Chemical Name | tert-butyl rac-[(2R,4S)-2-methyl-4-piperidinyl]carbamate |
| IUPAC Name | tert-butyl N-[(2R,4S)-2-methylpiperidin-4-yl]carbamate |
| InChI | InChI=1S/C11H22N2O2/c1-8-7-9(5-6-12-8)13-10(14)15-11(2,3)4/h8-9,12H,5-7H2,1-4H3,(H,13,14)/t8-,9+/m1/s1 |
| InChI Key | NURXHODEVCLVNT-BDAKNGLRSA-N |
| MDL Number | MFCD22397556 |
| Molecular Formula | C11H22N2O2 |
| Molecular Weight | 214.3046 |
| SMILES | C[C@@H]1C[C@H](CCN1)NC(=O)OC(C)(C)C |
| Synonyms | SCHEMBL20499934,
1657033-37-8,
MFCD28398161,
ZINC73657435,
tert-butyl [trans-2-methyl-4-piperidinyl]carbamate,
t-Butyl rac-[(2R,4S)-2-methyl-4-piperidinyl]carbamate,
tert-butyl rac-[(2R,4S)-2-methyl-4-piperidinyl]carbamate,
1820574-83-1,
|
| Complexity | 223 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.168g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.309g/mol |
| Monoisotopic Mass | 214.168g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 50.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number