(4-Methoxyphenyl)(4-piperidyl)methanone Hydrochloride - CAS 25519-82-8
Catalog: |
BB018942 |
Product Name: |
(4-Methoxyphenyl)(4-piperidyl)methanone Hydrochloride |
CAS: |
25519-82-8 |
Synonyms: |
(4-methoxyphenyl)-(4-piperidinyl)methanone;hydrochloride; (4-methoxyphenyl)-piperidin-4-ylmethanone;hydrochloride |
IUPAC Name: | (4-methoxyphenyl)-piperidin-4-ylmethanone;hydrochloride |
Description: | (4-Methoxyphenyl)(4-piperidyl)methanone Hydrochloride (CAS# 25519-82-8) is a useful research chemical. |
Molecular Weight: | 255.74 |
Molecular Formula: | C13H18ClNO2 |
Canonical SMILES: | COC1=CC=C(C=C1)C(=O)C2CCNCC2.Cl |
InChI: | InChI=1S/C13H17NO2.ClH/c1-16-12-4-2-10(3-5-12)13(15)11-6-8-14-9-7-11;/h2-5,11,14H,6-9H2,1H3;1H |
InChI Key: | BBDTWYQCXXFKDH-UHFFFAOYSA-N |
Boiling Point: | 371.3 °C at 760 mmHg |
LogP: | 3.00830 |
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 |
KR-20170115315-A | Novel heterocyclic derivatives, and use thereof | 20160407 |
US-10300155-B2 | Alpha-synuclein ligands | 20151231 |
US-2017189566-A1 | Alpha-synuclein ligands | 20151231 |
AU-2016349148-A1 | 1,4-dicarbonyl-piperidyl derivatives | 20151102 |
CA-3003600-A1 | 1,4-dicarbonyl-piperidyl derivatives | 20151102 |
Complexity: | 228 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 255.1026065 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 255.1026065 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 38.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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Related Functional Groups
Piperidines
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