1-(4-Pyridinylmethyl)-4-piperidone - CAS 126832-82-4
Catalog: |
BB006678 |
Product Name: |
1-(4-Pyridinylmethyl)-4-piperidone |
CAS: |
126832-82-4 |
Synonyms: |
1-(pyridin-4-ylmethyl)-4-piperidinone; 1-(pyridin-4-ylmethyl)piperidin-4-one |
IUPAC Name: | 1-(pyridin-4-ylmethyl)piperidin-4-one |
Description: | 1-(4-Pyridinylmethyl)-4-piperidone (CAS# 126832-82-4) is a useful research chemical. |
Molecular Weight: | 190.24 |
Molecular Formula: | C11H14N2O |
Canonical SMILES: | C1CN(CCC1=O)CC2=CC=NC=C2 |
InChI: | InChI=1S/C11H14N2O/c14-11-3-7-13(8-4-11)9-10-1-5-12-6-2-10/h1-2,5-6H,3-4,7-9H2 |
InChI Key: | HGXOGFPPULJEEV-UHFFFAOYSA-N |
Boiling Point: | 337.466 °C at 760 mmHg |
Density: | 1.149 g/cm3 |
MDL: | MFCD05864751 |
LogP: | 1.18440 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021086879-A1 | Compounds and methods of use | 20191028 |
US-11077101-B1 | Compounds and methods of use | 20180718 |
US-2016091807-A1 | Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus and phthalocyanine crystal | 20130528 |
WO-2014192840-A1 | Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus and phthalocyanine crystal | 20130528 |
US-2008176883-A1 | Aminopyrrolidines as chemokine receptor antagonists | 20061117 |
Complexity: | 190 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 190.110613074 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 190.110613074 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 33.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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