Methyl pipecolinate hydrochloride - ≥97% , CAS No.32559-18-5

CAS: 32559-18-5 Cat. No.: M169575 Formule: C₇H₁₃NO₂ · HCl Poids moléculaire: 179.64 Numéro CE: 628-243-3

GRADE & PURITY ≥97%

Synonyms

2y34 | EN300-23808 | n,o-bis-(trimethylsilyl)acetamid | DANTROLENE (USP-RS) | F0001-0967 | M2591 | MFCD00672366 | CI 920 | FT-0637734 | SB42964 | FT-0637713 | Methy pipecolinate HCl | H-Homopro-OMe . HCl | 2-Piperidinecarboxylic acid, methyl ester, hydroc

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

2y34 | EN300-23808 | n,o-bis-(trimethylsilyl)acetamid | DANTROLENE (USP-RS) | F0001-0967 | M2591 | MFCD00672366 | CI 920 | FT-0637734 | SB42964 | FT-0637713 | Methy pipecolinate HCl | H-Homopro-OMe . HCl | 2-Piperidinecarboxylic acid, methyl ester, hydroc

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥97%

Noms et identifiants

Pubchem Sid

488198386

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488198386

Sourires canoniques

COC(=O)C1CCCCN1.Cl

IUPAC Name

methyl piperidine-2-carboxylate;hydrochloride

InChIKey

APCHKWZTSCBBJX-UHFFFAOYSA-N

INCHI

1S/C7H13NO2.ClH/c1-10-7(9)6-4-2-3-5-8-6;/h6,8H,2-5H2,1H3;1H

Isomères SMILES

COC(=O)C1CCCCN1.Cl

WGK Allemagne

3

Poids moléculaire

179.64

Reaxy-Rn

3914053

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3914053&ln=

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 Alpha amino acid esters

• 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: Alpha amino acid esters
• Alternative Parents: Piperidinecarboxylic acids Methyl esters Monocarboxylic acids and derivatives Dialkylamines Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alpha-amino acid ester - Piperidinecarboxylic acid - Piperidine - Methyl ester - Carboxylic acid ester - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Azacycle - Organoheterocyclic compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxygen compound - Hydrochloride - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
• 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

Propriétés chimiques et physiques

• Poids moléculaire: 179.640 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 179.071 Da
• Monoisotopic Mass: 179.071 Da
• Topological Polar Surface Area: 38.300 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 125.000
• 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

XLogP3

Foire aux questions

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 32559-18-5, the molecular formula is C7H14ClNO2, and the molecular weight is 179.64 g/mol. InChIKey APCHKWZTSCBBJX-UHFFFAOYSA-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.

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.