| CAS Number | 239073-94-0 |
| Catalog Number | AG00BNAX(AGN-PC-0QZXBT) |
| Chemical Name | 1-Boc-4-hydroxymethyl-4-methoxy-piperidine |
| IUPAC Name | tert-butyl 4-(hydroxymethyl)-4-methoxypiperidine-1-carboxylate |
| InChI | InChI=1S/C12H23NO4/c1-11(2,3)17-10(15)13-7-5-12(9-14,16-4)6-8-13/h14H,5-9H2,1-4H3 |
| InChI Key | AXXVKHFKOZNEOR-UHFFFAOYSA-N |
| MDL Number | MFCD11845497 |
| Molecular Formula | C12H23NO4 |
| Molecular Weight | 245.3153 |
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)(CO)OC |
| Synonyms | 239073-94-0,
tert-butyl 4-(hydroxymethyl)-4-methoxypiperidine-1-carboxylate,
1-BOC-4-hydroxymethyl-4-methoxy-piperidine,
SCHEMBL6896206,
DTXSID60634244,
AXXVKHFKOZNEOR-UHFFFAOYSA-N,
ZINC43220671,
SB15557,
DA-43107,
1-BOC-4-hydroxymethyl-4-methoxypiperidine,
CS-0056559,
FT-0740893,
W-2497,
1-(tert-butoxycarbonyl)-4-methoxy-4-piperidinemethanol,
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| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.319g/mol |
| Monoisotopic Mass | 245.163g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 59A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
Lot Number