L-Proline β-naphthylamide hydrochloride - ≥98% , CAS No.97216-16-5

CAS: 97216-16-5 Cat. No.: L351741 Fórmula: C₁₅H₁₆N₂O・HCl Peso molecular: 276.76 Número CE: 624-606-5 PubChem CID: 16218571

GRADE & PURITY ≥98%

Synonyms

L-Proline beta-naphthylamide hydrochloride, >=99% | L-Proline-2-naphthylamide hydrochloride | L-Proline beta-naphthylamide hydrochloride | L-Proline 2-naphthylamide hydrochloride | H-Pro-bNA HCl | MFCD00038937 | (S)-N-(naphthalen-2-yl)pyrrolidine-2-carbox

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinónimos

L-Proline beta-naphthylamide hydrochloride, >=99% | L-Proline-2-naphthylamide hydrochloride | L-Proline beta-naphthylamide hydrochloride | L-Proline 2-naphthylamide hydrochloride | H-Pro-bNA HCl | MFCD00038937 | (S)-N-(naphthalen-2-yl)pyrrolidine-2-carbox

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

504768352

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504768352

Sorrisos canónicos

C1CC(NC1)C(=O)NC2=CC3=CC=CC=C3C=C2.Cl

IUPAC Name

(2S)-N-naphthalen-2-ylpyrrolidine-2-carboxamide;hydrochloride

InChIKey

UKXYCTFKKXKIPY-UQKRIMTDSA-N

INCHI

1S/C15H16N2O.ClH/c18-15(14-6-3-9-16-14)17-13-8-7-11-4-1-2-5-12(11)10-13;/h1-2,4-5,7-8,10,14,16H,3,6,9H2,(H,17,18);1H/t14-;/m0./s1

SMILES isoméricas

C1C[C@H](NC1)C(=O)NC2=CC3=CC=CC=C3C=C2.Cl

PubChem CID

16218571

Peso molecular

276.76

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Proline and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Proline and derivatives
• Alternative Parents: Alpha amino acid amides Naphthalenes Pyrrolidinecarboxamides N-arylamides Secondary carboxylic acid amides Dialkylamines Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Proline or derivatives - Alpha-amino acid amide - Naphthalene - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - N-arylamide - Benzenoid - Pyrrolidine - Carboxamide group - Secondary carboxylic acid amide - Secondary aliphatic amine - Azacycle - Secondary amine - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Amine - Hydrochloride - Carbonyl group - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• 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.

DOI: 10.1186/s13321-016-0174-y

Propriedades químicas e físicas

• Solubilidade: Soluble in Glacial Acetic Acid:Water (1:1): 50 mg/mL
• Sensibilidade: Moisture sensitive
• Peso molecular: 276.760 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 276.103 Da
• Monoisotopic Mass: 276.103 Da
• Topological Polar Surface Area: 41.100 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 305.000
• 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: 2

XLogP3

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 97216-16-5, the molecular formula is C15H17ClN2O, and the molecular weight is 276.76 g/mol. InChIKey UKXYCTFKKXKIPY-UQKRIMTDSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.