Azetidine hydrochloride - ≥97% , CAS No.36520-39-5

CAS: 36520-39-5 Cat. No.: A103569 Summenformel: C₃H₇N · HCl Molekulargewicht: 93.56 EG-Nummer: 627-415-5

GRADE & PURITY ≥97%

Synonyms

Azetidine hydrochloride | A6310 | Azetidinehydrochloride | azetidine-hydrochloride | Z1741968337 | AKOS005259327 | Trimethyleneimine hydrochloride | Azetidine, hydrochloride | MFCD00008680 | C3H8ClN | FT-0650368 | BP-12321 | F0001-1044 | azetidine;hydroch

Storage

Room temperature,Argon charged

Shipped In

Normal

Übersicht

Azetidine hydrochloride is a building block for azetidine synthesis and a pharmaceutical intermediate.

Specifications

Synonyme

Azetidine hydrochloride | A6310 | Azetidinehydrochloride | azetidine-hydrochloride | Z1741968337 | AKOS005259327 | Trimethyleneimine hydrochloride | Azetidine, hydrochloride | MFCD00008680 | C3H8ClN | FT-0650368 | BP-12321 | F0001-1044 | azetidine;hydroch

Spezifikationen & Reinheit

≥97%

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥97%

Namen und Kennungen

Pubchem Sid

488198022

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488198022

Kanonisches Lächeln

C1CNC1.Cl

IUPAC Name

azetidine;hydrochloride

InChIKey

HGQULGDOROIPJN-UHFFFAOYSA-N

INCHI

1S/C3H7N.ClH/c1-2-4-3-1;/h4H,1-3H2;1H

Isomere SMILES

C1CNC1.Cl

WGK Deutschland

3

Molekulargewicht

93.56

Reaxy-Rn

5937057

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5937057&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Azetidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Azetidines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Azetidines
• Alternative Parents: Dialkylamines Azacyclic compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Azetidine - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Hydrochloride - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as azetidines. These are organic compounds containing a saturated four-member heterocycle where one nitrogen atom replaces a 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.

DOI: 10.1186/s13321-016-0174-y

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water (103.8°C at 760 mmHg).
• Empfindlichkeit: Hygroscopic
• Flammpunkt (°F): 306°F
• Flammpunkt (°C): 152 °C
• Schmelzpunkt (°C): 295°C
• Molekulargewicht: 93.550 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 93.0345 Da
• Monoisotopic Mass: 93.0345 Da
• Topological Polar Surface Area: 12.000 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 17.200
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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