1-Boc-2-(hydroxymethyl)-3-phenylpiperidine - CAS 1015005-11-4
Catalog: |
BB000523 |
Product Name: |
1-Boc-2-(hydroxymethyl)-3-phenylpiperidine |
CAS: |
1015005-11-4 |
Synonyms: |
2-(hydroxymethyl)-3-phenyl-1-piperidinecarboxylic acid tert-butyl ester; tert-butyl 2-(hydroxymethyl)-3-phenylpiperidine-1-carboxylate |
IUPAC Name: | tert-butyl 2-(hydroxymethyl)-3-phenylpiperidine-1-carboxylate |
Description: | 1-Boc-2-(hydroxymethyl)-3-phenylpiperidine (CAS# 1015005-11-4 ) is a useful research chemical. |
Molecular Weight: | 291.39 |
Molecular Formula: | C17H25NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCCC(C1CO)C2=CC=CC=C2 |
InChI: | InChI=1S/C17H25NO3/c1-17(2,3)21-16(20)18-11-7-10-14(15(18)12-19)13-8-5-4-6-9-13/h4-6,8-9,14-15,19H,7,10-12H2,1-3H3 |
InChI Key: | HFQHNDFKURGDBS-UHFFFAOYSA-N |
LogP: | 3.09990 |
Publication Number | Title | Priority Date |
ES-2528129-T3 | Sulfonyl piperazine derivative substituted at position 3 | 20080206 |
AU-2007297627-A1 | Piperidine and pyrrolidine beta-secretase inhibitors for the treatment of Alzheimer's disease | 20060921 |
CA-2664130-A1 | Piperidine and pyrrolidine beta-secretase inhibitors for the treatment of alzheimer's disease | 20060921 |
EP-2077719-A2 | Piperidine and pyrrolidine beta-secretase inhibitors for the treatment of alzheimer's disease | 20060921 |
EP-2077719-B1 | Piperidine and pyrrolidine beta-secretase inhibitors for the treatment of alzheimer's disease | 20060921 |
Complexity: | 344 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 291.18344366 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 291.18344366 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 49.8 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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