3-Methyl-5-nitro-1H-indole-2-carboxylic acid

Base Information

• Chemical Name: 3-Methyl-5-nitro-1H-indole-2-carboxylic acid
• CAS No.: 446830-73-5
• Molecular Formula: C10H8N2O4
• Molecular Weight: 220.18
• Hs Code.: 2933990090
• European Community (EC) Number: 826-094-0
• ChEMBL ID: CHEMBL1373205
• Mol file: 446830-73-5.mol

Synonyms:3-Methyl-5-nitro-1H-indole-2-carboxylic acid;446830-73-5;MLS000716383;SMR000277900;Oprea1_006521;SCHEMBL6847834;CHEMBL1373205;BDBM61818;cid_1078087;BUWLROXHVDVDKY-UHFFFAOYSA-N;HMS2658N12;WSA83073;AKOS000300634;CS-0234828;3-Methyl-5-nitro-1H-indole-2-carboxylicacid;EN300-148029;3-methyl-5-nitro-1 h-indole-2-carboxylic acid;SR-01000324661;SR-01000324661-1

Chemical Property of 3-Methyl-5-nitro-1H-indole-2-carboxylic acid

Chemical Property:

• PSA: 98.91000
• LogP: 2.60590
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 220.04840674
• Heavy Atom Count: 16
• Complexity: 314

Purity/Quality:

98%min ^*data from raw suppliers

3-Methyl-5-nitro-1H-indole-2-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(NC2=C1C=C(C=C2)[N+](=O)[O-])C(=O)O