3H-Indole-2-carboxylic acid, 3-diazo-, ethyl ester

Base Information

• Chemical Name: 3H-Indole-2-carboxylic acid, 3-diazo-, ethyl ester
• CAS No.: 89607-68-1
• Molecular Formula: C11H9N3O2
• Molecular Weight: 215.20800
• DSSTox Substance ID: DTXSID70349695
• Nikkaji Number: J1.369.512A
• Pharos Ligand ID: NFXPAPLWX144
• ChEMBL ID: CHEMBL1589298

Synonyms:MLS000079382;SMR000038483;89607-68-1;3H-Indole-2-carboxylic acid, 3-diazo-, ethyl ester;3-diazo-3H-indole-2-carboxylic acid ethyl ester;(Z)-(3-diazonioindol-2-ylidene)-ethoxymethanolate;CHEMBL1589298;BDBM38877;cid_5389021;DTXSID70349695;ethyl 3-diazoindole-2-carboxylate;HHXBUEDUJDFQEA-UHFFFAOYSA-N;STK721865;AKOS005524071;ethyl 3-diazo-3H-indole-2-carboxylate;NCGC00020974-01;NCGC00020974-02;(Z)-(3-diazonio-2-indolylidene)-ethoxymethanolate;(Z)-(3-diazonioindol-2-ylidene)-ethoxy-methanolate;Ethyl 3-(1lambda5-diazynylidene)-3H-indole-2-carboxylate

Chemical Property of 3H-Indole-2-carboxylic acid, 3-diazo-, ethyl ester

Chemical Property:

• PSA: 76.05000
• LogP: 0.87136
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 215.069476538
• Heavy Atom Count: 16
• Complexity: 383

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=NC2=CC=CC=C2C1=[N+]=[N-]

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