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(2R)-2-methylpiperidine-2-carboxylic acid - 97%, high purity , CAS No.105141-61-5
Basic Description
Synonyms
105141-61-5 | (R)-2-methylpiperidine-2-carboxylic acid | (2R)-2-Methylpiperidine-2-carboxylic acid | 2-Piperidinecarboxylicacid,2-methyl-,(R)-(9ci) | 2-piperidinecarboxylic acid,2-methyl-,(r)- | SCHEMBL14488376 | DTXSID60993363 | GLNOAERYNWZGJY-SSDOTTSWSA-N | AMY24130 | CS
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 - Alpha amino acids and derivatives - Alpha amino acids
Direct Parent
L-alpha-amino acids
Alternative Parents
Piperidinecarboxylic acids Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
L-alpha-amino acid - Piperidinecarboxylic acid - Piperidine - Amino acid - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Organic oxide - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as l-alpha-amino acids. These are alpha amino acids which have the L-configuration of the alpha-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
(2R)-2-methylpiperidine-2-carboxylic acid
INCHI
InChI=1S/C7H13NO2/c1-7(6(9)10)4-2-3-5-8-7/h8H,2-5H2,1H3,(H,9,10)/t7-/m1/s1
InChIKey
GLNOAERYNWZGJY-SSDOTTSWSA-N
Smiles
CC1(CCCCN1)C(=O)O
Isomeric SMILES
C[C@@]1(CCCCN1)C(=O)O
PubChem CID
13205597
Molecular Weight
143.1836
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
143.180 g/mol
XLogP3
-1.800
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
143.095 Da
Monoisotopic Mass
143.095 Da
Topological Polar Surface Area
49.300 Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
147.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
1
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
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