methyl 2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate - ≥97% , CAS No.1638760-75-4

CAS: 1638760-75-4 Cat. No.: M630009 Molecular Weight: 246.05 PubChem CID: 92131078

GRADE & PURITY ≥97%

Synonyms

1638760-75-4 | methyl 2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate | 2,4-Dichloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid methyl ester | methyl2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate | AMY35762 | MFCD27987439 | SB14144 | AS-

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1638760-75-4 | methyl 2, 4-dichloro-7H-pyrrolo[2, 3-d]pyrimidine-5-carboxylate | 2, 4-Dichloro-7H-pyrrolo[2, 3-d]pyrimidine-5-carboxylic acid methyl ester | methyl2, 4-dichloro-7H-pyrrolo[2, 3-d]pyrimidine-5-carboxylate | AMY35762 | MFCD27987439 | SB14144 | AS-

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: COC(=O)C1=CNC2=C1C(=NC(=N2)Cl)Cl
• IUPAC Name: methyl 2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate
• InChIKey: FICZFQMKBMQCQT-UHFFFAOYSA-N
• INCHI: 1S/C8H5Cl2N3O2/c1-15-7(14)3-2-11-6-4(3)5(9)12-8(10)13-6/h2H,1H3,(H,11,12,13)
• PubChem CID: 92131078
• Molecular Weight: 246.05

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Pyrrolopyrimidines
      • Subclass Pyrrolo[2,3-d]pyrimidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyrrolopyrimidines
• Subclass: Pyrrolo[2,3-d]pyrimidines
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrolo[2,3-d]pyrimidines
• Alternative Parents: Pyrrole carboxylic acids and derivatives 2-halopyrimidines Substituted pyrroles Aryl chlorides Vinylogous amides Methyl esters Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pyrrolo[2,3-d]pyrimidine - Pyrrole-3-carboxylic acid or derivatives - 2-halopyrimidine - Halopyrimidine - Aryl chloride - Aryl halide - Substituted pyrrole - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Methyl ester - Pyrrole - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as pyrrolo[2,3-d]pyrimidines. These are aromatic heteropolycyclic compounds containing a pyrrolo[2,3-d]pyrimidine ring system, which is an pyrrolopyrimidine isomers having the 3 ring nitrogen atoms at the 1-, 5-, and 7-positions.
• 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