2-Amino-5-phenylthiazole - ≥98% , CAS No.39136-63-5

CAS: 39136-63-5 Cat. No.: A184243 Peso molecular: 176.2 Número EC: 254-312-9

GRADE & PURITY ≥98%

Synonyms

P2865 | 5-phenyl-1,3-thiazol-2-amine | BB 0301294 | FS-3584 | Oprea1_837745 | AC-7236 | 2-thiazolamine, 5-phenyl- | Cambridge id 5655136 | CEPHALOTHINSODIUMSALT | A846632 | SY005298 | 5-Phenylthiazol-2-amine | DTXSID50192383 | SCHEMBL69900 | AB01318 | EN3

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

P2865 | 5-phenyl-1, 3-thiazol-2-amine | BB 0301294 | FS-3584 | Oprea1_837745 | AC-7236 | 2-thiazolamine, 5-phenyl- | Cambridge id 5655136 | CEPHALOTHINSODIUMSALT | A846632 | SY005298 | 5-Phenylthiazol-2-amine | DTXSID50192383 | SCHEMBL69900 | AB01318 | EN3

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504760299
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504760299
• Sonrisas canónicas: C1=CC=C(C=C1)C2=CN=C(S2)N
• IUPAC Name: 5-phenyl-1,3-thiazol-2-amine
• InChIKey: LSLUWQIENURREM-UHFFFAOYSA-N
• INCHI: 1S/C9H8N2S/c10-9-11-6-8(12-9)7-4-2-1-3-5-7/h1-6H,(H2,10,11)
• Isómeros SMILES: C1=CC=C(C=C1)C2=CN=C(S2)N
• Peso molecular: 176.2
• Reaxy-Rn: 127417
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=127417&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Azoles
• Subclass: Thiazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: 2,5-disubstituted thiazoles
• Alternative Parents: Benzene and substituted derivatives 2-amino-1,3-thiazoles Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2,5-disubstituted 1,3-thiazole - 1,3-thiazol-2-amine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Sensibilidad: Light sensitive;Air sensitive
• Punto de fusión (°C): 206℃
• Peso molecular: 176.240 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 176.041 Da
• Monoisotopic Mass: 176.041 Da
• Topological Polar Surface Area: 67.200 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 145.000
• 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: 1