2-Amino-5-chlorothiazole hydrochloride - ≥97% , CAS No.55506-37-1

CAS: 55506-37-1 Cat. No.: A113875 Molecular Weight: 171.05 EC Number: 259-680-4 PubChem CID: 148743

GRADE & PURITY ≥97%

Synonyms

2-AMINO-5-CHLOROTHIAZOLE HCl | 5-CHLOROTHIAZOL-2-AMINE HCL | 5-chloro-thiazol-2-ylamine hydrochloride | 2-amino-5-chlorothiazole hydrochloric acid | 2-AMINO-5-CHLOROTHIAZOLEHYDROCHLORIDE | 2-amino-5-chlorothiazole-hydrochloride | AKOS015847534 | AC-23073

Storage

Room temperature

Shipped In

Normal

Overview

2-Amino-5-chlorothiazole hydrochloride is used as starting reagent in the synthesis of 2-chloro-6-methylimidazo[2,1-b]thiazole.
Reactant for preparation of biologically active thiazole derivatives 2-Amino-5-chlorothiazole hydrochloride was used as starting reagent in the synthesis of 2-chloro-6-methylimidazo[2,1-b]thiazole.

Specifications

Synonyms

2-AMINO-5-CHLOROTHIAZOLE HCl | 5-CHLOROTHIAZOL-2-AMINE HCL | 5-chloro-thiazol-2-ylamine hydrochloride | 2-amino-5-chlorothiazole hydrochloric acid | 2-AMINO-5-CHLOROTHIAZOLEHYDROCHLORIDE | 2-amino-5-chlorothiazole-hydrochloride | AKOS015847534 | AC-23073

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Pubchem Sid: 488188213
• Canonical Smiles: C1=C(SC(=N1)N)Cl.Cl
• IUPAC Name: 5-chloro-1,3-thiazol-2-amine;hydrochloride
• InChIKey: GTMGFQYVLSQTKP-UHFFFAOYSA-N
• INCHI: 1S/C3H3ClN2S.ClH/c4-2-1-6-3(5)7-2;/h1H,(H2,5,6);1H
• Isomeric SMILES: C1=C(SC(=N1)N)Cl.Cl
• WGK Germany: 3
• RTECS: XJ1262800
• PubChem CID: 148743
• Molecular Weight: 171.05

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Azoles
      • Subclass Thiazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Azoles
• Subclass: Thiazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: 2,5-disubstituted thiazoles
• Alternative Parents: Aryl chlorides 2-amino-1,3-thiazoles Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Organochlorides Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2,5-disubstituted 1,3-thiazole - Aryl chloride - Aryl halide - 1,3-thiazol-2-amine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrochloride - Primary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Amine - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as 2,5-disubstituted thiazoles. These are compounds containing a thiazole ring substituted at positions 2 and 5 only.
• 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

Chemical and Physical Properties

• Solubility: Soluble in water
• Melt Point(°C): 164-167°C
• Molecular Weight: 171.050 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 169.947 Da
• Monoisotopic Mass: 169.947 Da
• Topological Polar Surface Area: 67.200 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 70.000
• 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

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