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4-amino-1-methylpiperidin-2-one hydrochloride - 97%, high purity , CAS No.1373223-45-0
Discover 4-amino-1-methylpiperidin-2-one hydrochloride by Aladdin Scientific in 97% for only $314.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
4-Amino-1-methylpiperidin-2-one hydrochloride | 1373223-45-0 | 1-Methyl-4-amino-2-piperidinone hydrochloride | 4-Amino-1-methyl-piperidin-2-one hydrochloride | 4-amino-1-methylpiperidin-2-one;hydrochloride | MFCD17015881 | 4-Amino-1-methylpiperidin-2-one HCl | 2-Piperi
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Piperidinones Delta lactams Aminopiperidines Tertiary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - 4-aminopiperidine - Delta-lactam - Piperidinone - Piperidine - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrochloride - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
IUPAC Name
4-amino-1-methylpiperidin-2-one;hydrochloride
INCHI
InChI=1S/C6H12N2O.ClH/c1-8-3-2-5(7)4-6(8)9;/h5H,2-4,7H2,1H3;1H
InChIKey
YWKDSIRYNGGSHR-UHFFFAOYSA-N
Smiles
CN1CCC(CC1=O)N.Cl
Isomeric SMILES
CN1CCC(CC1=O)N.Cl
Molecular Weight
164.63
Reaxy-Rn
30477146
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=30477146&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
164.630 g/mol
XLogP3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
0
Exact Mass
164.072 Da
Monoisotopic Mass
164.072 Da
Topological Polar Surface Area
46.300 Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
124.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
2
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