3-(2-Chloroethyl)-2-methyl-1h-indole-5-carboxylic acid

Base Information

• Chemical Name: 3-(2-Chloroethyl)-2-methyl-1h-indole-5-carboxylic acid
• CAS No.: 889953-68-8
• Molecular Formula: C12H12 Cl N O2
• Molecular Weight: 237.68
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID90587698
• Wikidata: Q82480198
• Mol file: 889953-68-8.mol

Synonyms:889953-68-8;3-(2-chloroethyl)-2-methyl-1h-indole-5-carboxylic acid;3-(2-Chloro-ethyl)-2-methyl-1H-indole-5-carboxylic acid;DTXSID90587698;MFCD06660480;AKOS005257177;3-(2-chloroethyl)-2-methyl-1h-indole-5-carboxylicacid

Chemical Property of 3-(2-Chloroethyl)-2-methyl-1h-indole-5-carboxylic acid

Chemical Property:

• Vapor Pressure: 4.05E-10mmHg at 25°C
• Refractive Index: 1.661
• Boiling Point: 482.5°C at 760 mmHg
• Flash Point: 245.6°C
• PSA: 53.09000
• Density: 1.359g/cm³
• LogP: 2.95580
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 237.0556563
• Heavy Atom Count: 16
• Complexity: 272

Purity/Quality:

95% ^*data from raw suppliers

3-(2-CHLORO-ETHYL)-2-METHYL-1H-INDOLE-5-CARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C2=C(N1)C=CC(=C2)C(=O)O)CCCl