4-(1-Piperidinyl)benzaldehyde - CAS 10338-57-5
Catalog: |
BB001102 |
Product Name: |
4-(1-Piperidinyl)benzaldehyde |
CAS: |
10338-57-5 |
Synonyms: |
4-piperidin-1-ylbenzaldehyde |
IUPAC Name: | 4-piperidin-1-ylbenzaldehyde |
Description: | 4-(1-Piperidinyl)benzaldehyde (CAS# 10338-57-5) is a useful research chemical. |
Molecular Weight: | 189.25 |
Molecular Formula: | C12H15NO |
Canonical SMILES: | C1CCN(CC1)C2=CC=C(C=C2)C=O |
InChI: | InChI=1S/C12H15NO/c14-10-11-4-6-12(7-5-11)13-8-2-1-3-9-13/h4-7,10H,1-3,8-9H2 |
InChI Key: | ILJVPSVCFVQUAD-UHFFFAOYSA-N |
Boiling Point: | 344.3 °C at 760 mmHg |
Melting Point: | 61-64 °C |
Purity: | 95 % |
Density: | 1.091 g/cm3 |
MDL: | MFCD00778395 |
LogP: | 2.55440 |
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-2021124172-A1 | 3-(5-methoxy-1-oxoisoindolin-2-yl)piperidine-2,6-dione derivatives and uses thereof | 20191218 |
DE-102019218788-A1 | Multi-tonal hair coloring process in three steps | 20191203 |
WO-2021110306-A1 | Multi-tone hair dyeing method in three steps | 20191203 |
WO-2021078132-A1 | Inhibitors of mtor-mediated induction of autophagy | 20191021 |
US-2020392119-A1 | Novel chalcone-based chemotherapeutic compound for triple negative breast cancer | 20190613 |
PMID | Publication Date | Title | Journal |
21589059 | 20101020 | (E)-2-[4-(Piperidin-1-yl)benzyl-idene]-2,3-dihydro-1H-inden-1-one | Acta crystallographica. Section E, Structure reports online |
12014970 | 20020523 | Synthesis, receptor potency, and selectivity of halogenated diphenylpiperidines as serotonin 5-HT2A ligands for PET or SPECT brain imaging | Journal of medicinal chemistry |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.115364102 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.115364102 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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