oxazolo[5,4-b]pyridin-2-amine - ≥97% , CAS No.118767-91-2

CAS: 118767-91-2 Cat. No.: O627164 Molecular Weight: 135.12 EC Number: 822-447-8 PubChem CID: 18671456

GRADE & PURITY ≥97%

Synonyms

2-aminooxazolopyridine | AKOS016002759 | SCHEMBL483234 | Oxazolo[5,4-b]pyridin-2-ylamine | oxazolo[5,4-b]pyridin-2-yl-amine | Z1255498595 | [1,3]oxazolo[5,4-b]pyridin-2-amine | Oxazolo[5,4-b]pyridine, 2-amino- (6CI) | F13374 | MFCD15526653 | EN300-1707672

Storage

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

Shipped In

Wet ice

Specifications

Synonyms

2-aminooxazolopyridine | AKOS016002759 | SCHEMBL483234 | Oxazolo[5, 4-b]pyridin-2-ylamine | oxazolo[5, 4-b]pyridin-2-yl-amine | Z1255498595 | [1, 3]oxazolo[5, 4-b]pyridin-2-amine | Oxazolo[5, 4-b]pyridine, 2-amino- (6CI) | F13374 | MFCD15526653 | EN300-1707672

Specifications & Purity

≥97%

Storage

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

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C1=CC2=C(N=C1)OC(=N2)N
• IUPAC Name: [1,3]oxazolo[5,4-b]pyridin-2-amine
• InChIKey: YSQNOJMVGVZJRJ-UHFFFAOYSA-N
• INCHI: 1S/C6H5N3O/c7-6-9-4-2-1-3-8-5(4)10-6/h1-3H,(H2,7,9)
• Isomeric SMILES: C1=CC2=C(N=C1)OC(=N2)N
• Alternate CAS: 118767-91-2
• PubChem CID: 18671456
• Molecular Weight: 135.12

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Oxazolopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Oxazolopyridines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Oxazolopyridines
• Alternative Parents: Pyridines and derivatives Primary aromatic amines Oxazoles Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 1,3-oxazolopyridine - Primary aromatic amine - Pyridine - Azole - Oxazole - Heteroaromatic compound - Azacycle - Oxacycle - Organopnictogen compound - Organic oxygen compound - Primary amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as oxazolopyridines. These are polycyclic compounds containing an oxazole ring fused to a pyridine ring.
• 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

• Molecular Weight: 135.120 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 135.043 Da
• Monoisotopic Mass: 135.043 Da
• Topological Polar Surface Area: 64.900 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 130.000
• 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