1-Methyl-d3-2-(4-methylbenzoyl)pyrrole

Base Information

• Chemical Name: 1-Methyl-d3-2-(4-methylbenzoyl)pyrrole
• CAS No.: 1185001-74-4
• Molecular Formula: C13H13NO
• Molecular Weight: 202.27
• DSSTox Substance ID: DTXSID30676035
• Wikidata: Q82598866
• Mol file: 1185001-74-4.mol

Synonyms:1-Methyl-d3-2-(4-methylbenzoyl)pyrrole;1185001-74-4;(4-methylphenyl)-[1-(trideuteriomethyl)pyrrol-2-yl]methanone;DTXSID30676035;(4-Methylphenyl)[1-(~2~H_3_)methyl-1H-pyrrol-2-yl]methanone

Chemical Property of 1-Methyl-d3-2-(4-methylbenzoyl)pyrrole

Chemical Property:

• Solubility.: Chloroform, Dichloromethane, Ethyl Acetate, Methanol
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 202.118544276
• Heavy Atom Count: 15
• Complexity: 231

Purity/Quality:

95% ^*data from raw suppliers

1-Methyl-d3-2-(4-methylbenzoyl)pyrrole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=CN2C
• Isomeric SMILES: [2H]C([2H])([2H])N1C=CC=C1C(=O)C2=CC=C(C=C2)C
• Uses: 1-Methyl-d3-2-(4-methylbenzoyl)pyrrole (cas# 1185001-74-4) is a compound useful in organic synthesis.