Benzyl 4-hydroxy-1-piperidinecarboxylate - CAS 95798-23-5
Catalog: |
BB041849 |
Product Name: |
Benzyl 4-hydroxy-1-piperidinecarboxylate |
CAS: |
95798-23-5 |
Synonyms: |
benzyl 4-hydroxypiperidine-1-carboxylate |
IUPAC Name: | benzyl 4-hydroxypiperidine-1-carboxylate |
Description: | Benzyl 4-hydroxy-1-piperidinecarboxylate (CAS# 95798-23-5) is an intermediate in the synthesis of Haloperidol-d4 (H103702), which is antidyskinetic; antipsychotic. |
Molecular Weight: | 235.28 |
Molecular Formula: | C13H17NO3 |
Canonical SMILES: | C1CN(CCC1O)C(=O)OCC2=CC=CC=C2 |
InChI: | InChI=1S/C13H17NO3/c15-12-6-8-14(9-7-12)13(16)17-10-11-4-2-1-3-5-11/h1-5,12,15H,6-10H2 |
InChI Key: | JKIUUDJOCYHIGY-UHFFFAOYSA-N |
Boiling Point: | 167 °C / 0.2 mmHg (lit.) |
Density: | 1.554 g/cm3 |
MDL: | MFCD01863722 |
LogP: | 1.71780 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021148420-A1 | Novel heterocyclic compounds | 20200122 |
WO-2021127404-A1 | Tricyclic pyridones and pyrimidones | 20191220 |
WO-2021041671-A1 | Kras g12d inhibitors | 20190829 |
WO-2021011913-A1 | Tau-protein targeting compounds and associated methods of use | 20190717 |
WO-2020264499-A1 | Irak degraders and uses thereof | 20190628 |
Complexity: | 243 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 235.12084340 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 235.12084340 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 49.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Alcohols and Derivatives
Piperidines
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS