4-Hydroxy-7-azaindole - ≥98% , CAS No.74420-02-3

CAS: 74420-02-3 Cat. No.: H137025 Formule: C₇H₆N₂O Poids moléculaire: 134.14

GRADE & PURITY ≥98%

Synonyms

Z1198176784 | 1,7-dihydropyrrolo[2,3-b]pyridin-4-one | MFCD08272229 | FT-0647262 | PB23574 | 1,7-Dihydro-4H-pyrrolo[2,3-b]pyridin-4-one | 1H-pyrrolo[2,3-b]pyridine-4-ol | DTXSID90505539 | 1076197-59-5 | BCP21360 | 1H-Pyrrolo[2,3-b]pyridin-4(7H)-one | SY05

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

Z1198176784 | 1,7-dihydropyrrolo[2,3-b]pyridin-4-one | MFCD08272229 | FT-0647262 | PB23574 | 1,7-Dihydro-4H-pyrrolo[2,3-b]pyridin-4-one | 1H-pyrrolo[2,3-b]pyridine-4-ol | DTXSID90505539 | 1076197-59-5 | BCP21360 | 1H-Pyrrolo[2,3-b]pyridin-4(7H)-one | SY05

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

Pubchem Sid

488198198

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488198198

Sourires canoniques

C1=CNC2=C1C(=O)C=CN2

IUPAC Name

1,7-dihydropyrrolo[2,3-b]pyridin-4-one

InChIKey

IXIGMDXJXKDZOF-UHFFFAOYSA-N

INCHI

1S/C7H6N2O/c10-6-2-4-9-7-5(6)1-3-8-7/h1-4H,(H2,8,9,10)

Isomères SMILES

C1=CNC2=C1C(=O)C=CN2

Poids moléculaire

134.14

Reaxy-Rn

53857354

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=53857354&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyrrolopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyrrolopyridines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrolopyridines
• Alternative Parents: Pyridines and derivatives Vinylogous amides Pyrroles Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pyrrolopyridine - Pyridine - Heteroaromatic compound - Vinylogous amide - Pyrrole - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as pyrrolopyridines. These are compounds containing a pyrrolopyridine moiety, which consists of a pyrrole ring fused to a pyridine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
• 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: 134.140 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 134.048 Da
• Monoisotopic Mass: 134.048 Da
• Topological Polar Surface Area: 44.900 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 188.000
• 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

Foire aux questions

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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 74420-02-3, the molecular formula is C7H6N2O, and the molecular weight is 134.14 g/mol. InChIKey IXIGMDXJXKDZOF-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.