1-Cbz-4-(aminomethyl)piperidine - CAS 157023-34-2
Catalog: |
BB011283 |
Product Name: |
1-Cbz-4-(aminomethyl)piperidine |
CAS: |
157023-34-2 |
Synonyms: |
4-(aminomethyl)-1-piperidinecarboxylic acid (phenylmethyl) ester; benzyl 4-(aminomethyl)piperidine-1-carboxylate |
IUPAC Name: | benzyl 4-(aminomethyl)piperidine-1-carboxylate |
Description: | 1-Cbz-4-(aminomethyl)piperidine (CAS# 157023-34-2) is a useful research chemical. |
Molecular Weight: | 248.32 |
Molecular Formula: | C14H20N2O2 |
Canonical SMILES: | C1CN(CCC1CN)C(=O)OCC2=CC=CC=C2 |
InChI: | InChI=1S/C14H20N2O2/c15-10-12-6-8-16(9-7-12)14(17)18-11-13-4-2-1-3-5-13/h1-5,12H,6-11,15H2 |
InChI Key: | ABJVEAFRFGTATH-UHFFFAOYSA-N |
Boiling Point: | 385.7 °C at 760 mmHg |
Density: | 1.125 g/cm3 |
LogP: | 2.63210 |
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-2021083949-A1 | Bifunctional compounds for the treatment of cancer | 20191029 |
EP-3172197-A1 | Benzimidazole retinoic acid receptor-related orphan receptor modulators and uses thereof | 20140725 |
US-2016024052-A1 | Benzimidazole retinoic acid receptor-related orphan receptor modulators and uses thereof | 20140725 |
US-2017190712-A1 | Benzimidazole retinoic acid receptor-related orphan receptor modulators and uses thereof | 20140725 |
US-9771374-B2 | Benzimidazole retinoic acid receptor-related orphan receptor modulators and uses thereof | 20140725 |
Complexity: | 257 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 248.152477885 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 248.152477885 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 55.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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Amines and Anilines
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