| CAS Number | 1169762-18-8 |
| Catalog Number | AG000DFE(AGN-PC-0WNGZJ) |
| Chemical Name | Carbamic acid, N-[(3R)-3-methyl-3-piperidinyl]-, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl N-[(3R)-3-methylpiperidin-3-yl]carbamate |
| InChI | InChI=1S/C11H22N2O2/c1-10(2,3)15-9(14)13-11(4)6-5-7-12-8-11/h12H,5-8H2,1-4H3,(H,13,14)/t11-/m1/s1 |
| InChI Key | IKLFTJQKKCELGD-LLVKDONJSA-N |
| MDL Number | MFCD16996029 |
| Molecular Formula | C11H22N2O2 |
| Molecular Weight | 214.3046 |
| SMILES | C[C@@]1(CNCCC1)NC(OC(C)(C)C)=O |
| Synonyms | 1169762-18-8,
(3R)-3-(BOC-AMINO)-3-METHYLPIPERIDINE,
(R)-tert-Butyl (3-methylpiperidin-3-yl)carbamate,
(3R)-3-[(tert-butoxycarbonyl)amino]-3-methylpiperidine,
tert-butyl N-[(3R)-3-methylpiperidin-3-yl]carbamate,
SCHEMBL919128,
IKLFTJQKKCELGD-LLVKDONJSA-N,
CS-B1002,
MFCD16996029,
ZINC95707432,
AKOS027323560,
PB16673,
AS-51140,
KS-00000731,
Q-4097,
Carbamic acid, N-[(3R)-3-methyl-3-piperidinyl]-, 1,1-dimethylethyl ester,
(3S)-3-(Boc-amino)-3-methylpiperidine,
1363378-21-5,
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| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| 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 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number