1-[(4-methoxyphenyl)methyl]-5-methyl-4-nitro-1H-pyrazol-3-amine - ≥97% , CAS No.2227204-81-9

CAS: 2227204-81-9 Cat. No.: M632218 Molecular Weight: 262.27 PubChem CID: 137462376

GRADE & PURITY ≥97%

Synonyms

2227204-81-9 | 1-[(4-methoxyphenyl)methyl]-5-methyl-4-nitro-1H-pyrazol-3-amine | 1-(4-Methoxybenzyl)-5-methyl-4-nitro-1H-pyrazol-3-amine | starbld0030931 | SCHEMBL20702183 | MFCD31742959 | PB42013 | AS-79237 | P20231 | 1-[(4-methoxyphenyl)methyl]-5-methyl

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

2227204-81-9 | 1-[(4-methoxyphenyl)methyl]-5-methyl-4-nitro-1H-pyrazol-3-amine | 1-(4-Methoxybenzyl)-5-methyl-4-nitro-1H-pyrazol-3-amine | starbld0030931 | SCHEMBL20702183 | MFCD31742959 | PB42013 | AS-79237 | P20231 | 1-[(4-methoxyphenyl)methyl]-5-methyl

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC1=C(C(=NN1CC2=CC=C(C=C2)OC)N)[N+](=O)[O-]
• IUPAC Name: 1-[(4-methoxyphenyl)methyl]-5-methyl-4-nitropyrazol-3-amine
• InChIKey: UHMQEPLHADLQMD-UHFFFAOYSA-N
• INCHI: 1S/C12H14N4O3/c1-8-11(16(17)18)12(13)14-15(8)7-9-3-5-10(19-2)6-4-9/h3-6H,7H2,1-2H3,(H2,13,14)
• PubChem CID: 137462376
• Molecular Weight: 262.27

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Phenol ethers
      • Subclass Anisoles

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Phenol ethers
• Subclass: Anisoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Anisoles
• Alternative Parents: Phenoxy compounds Nitroaromatic compounds Methoxybenzenes Alkyl aryl ethers Imidolactams Heteroaromatic compounds Azoles Amidrazones Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrazones Azacyclic compounds Amidines Primary amines Organopnictogen compounds Organic zwitterions Organic oxoanionic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenoxy compound - Nitroaromatic compound - Methoxybenzene - Anisole - Alkyl aryl ether - Imidolactam - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Organic nitro compound - C-nitro compound - Carboxylic acid amidrazone - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrazone - Ether - Amidine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Primary amine - Organooxygen compound - Organonitrogen compound - Organic hyponitrite - Amine - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
• 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