1-Cbz-3-(hydroxymethyl)-5-methylpiperidine - CAS 1823835-83-1
Catalog: |
BB013956 |
Product Name: |
1-Cbz-3-(hydroxymethyl)-5-methylpiperidine |
CAS: |
1823835-83-1 |
Synonyms: |
3-(hydroxymethyl)-5-methyl-1-piperidinecarboxylic acid (phenylmethyl) ester; benzyl 3-(hydroxymethyl)-5-methylpiperidine-1-carboxylate |
IUPAC Name: | benzyl 3-(hydroxymethyl)-5-methylpiperidine-1-carboxylate |
Description: | 1-Cbz-3-(hydroxymethyl)-5-methylpiperidine (CAS# 1823835-83-1 ) is a useful research chemical. |
Molecular Weight: | 263.33 |
Molecular Formula: | C15H21NO3 |
Canonical SMILES: | CC1CC(CN(C1)C(=O)OCC2=CC=CC=C2)CO |
InChI: | InChI=1S/C15H21NO3/c1-12-7-14(10-17)9-16(8-12)15(18)19-11-13-5-3-2-4-6-13/h2-6,12,14,17H,7-11H2,1H3 |
InChI Key: | IPHXYYKYTZYTRT-UHFFFAOYSA-N |
LogP: | 2.21140 |
Complexity: | 289 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.15214353 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.15214353 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 49.8 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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