| CAS Number | 470668-97-4 |
| Catalog Number | AG00DB30(AGN-PC-0RUV38) |
| Chemical Name | 1-tert-Butyl 2-methyl 2-methylpiperidine-1,2-dicarboxylate |
| IUPAC Name | 1-O-tert-butyl 2-O-methyl 2-methylpiperidine-1,2-dicarboxylate |
| InChI | InChI=1S/C13H23NO4/c1-12(2,3)18-11(16)14-9-7-6-8-13(14,4)10(15)17-5/h6-9H2,1-5H3 |
| InChI Key | CHDNLIOSLJNCQY-UHFFFAOYSA-N |
| MDL Number | MFCD18642716 |
| Molecular Formula | C13H23NO4 |
| Molecular Weight | 257.3260 |
| SMILES | O=C(C1(C)N(C(OC(C)(C)C)=O)CCCC1)OC |
| Synonyms | 470668-97-4,
1-tert-butyl 2-methyl 2-methylpiperidine-1,2-dicarboxylate,
METHYL N-BOC-2-METHYLPIPERIDINE-2-CARBOXYLATE,
DTXSID90459164,
CS-M0543,
KS-000008QL,
3070AH,
MFCD18642716,
SB23226,
AS-36867,
AB0075380,
AX8266715,
BB 0262993,
X-1815,
1-O-tert-butyl 2-O-methyl 2-methylpiperidine-1,2-dicarboxylate,
C13H23NO4,
CID11219084,
Tert-butyl Methyl 2-methylpiperidine-1,2-dicarboxylate,
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| Complexity | 334 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 257.33g/mol |
| Monoisotopic Mass | 257.163g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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