3,3-Bis(hydroxymethyl)-1-Cbz-piperidine - CAS 1313369-57-1
Catalog: |
BB007294 |
Product Name: |
3,3-Bis(hydroxymethyl)-1-Cbz-piperidine |
CAS: |
1313369-57-1 |
Synonyms: |
3,3-bis(hydroxymethyl)-1-piperidinecarboxylic acid (phenylmethyl) ester; benzyl 3,3-bis(hydroxymethyl)piperidine-1-carboxylate |
IUPAC Name: | benzyl 3,3-bis(hydroxymethyl)piperidine-1-carboxylate |
Description: | 3,3-Bis(hydroxymethyl)-1-Cbz-piperidine (CAS# 1313369-57-1 ) is a useful research chemical. |
Molecular Weight: | 279.33 |
Molecular Formula: | C15H21NO4 |
Canonical SMILES: | C1CC(CN(C1)C(=O)OCC2=CC=CC=C2)(CO)CO |
InChI: | InChI=1S/C15H21NO4/c17-11-15(12-18)7-4-8-16(10-15)14(19)20-9-13-5-2-1-3-6-13/h1-3,5-6,17-18H,4,7-12H2 |
InChI Key: | UYFWZFFZNKABAN-UHFFFAOYSA-N |
LogP: | 1.32790 |
Complexity: | 311 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 279.14705815 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 279.14705815 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 70 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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