3-(2-hydroxyethyl)-1,2,3-benzotriazin-4(3H)-one

Base Information

• Chemical Name: 3-(2-hydroxyethyl)-1,2,3-benzotriazin-4(3H)-one
• CAS No.: 72553-67-4
• Molecular Formula: C9H9N3O2
• Molecular Weight: 191.18700
• DSSTox Substance ID: DTXSID60396315
• Wikidata: Q82196963
• ChEMBL ID: CHEMBL1529480

Synonyms:72553-67-4;3-(2-hydroxyethyl)-1,2,3-benzotriazin-4(3H)-one;1,2,3-Benzotriazin-4(3H)-one, 3-(2-hydroxyethyl)-;3-(2-hydroxyethyl)-3,4-dihydro-1,2,3-benzotriazin-4-one;3-(2-hydroxyethyl)-1,2,3-benzotriazin-4-one;MLS000696345;SCHEMBL4873292;CHEMBL1529480;DTXSID60396315;OENHVTAMUAZEKH-UHFFFAOYSA-N;HMS2601I07;MFCD05670210;AKOS005110375;MS-2837;SMR000337534;3-(2-hydroxyethyl)-1,2,3-benzotriazin-4(3H)one

Chemical Property of 3-(2-hydroxyethyl)-1,2,3-benzotriazin-4(3H)-one

Chemical Property:

• PSA: 68.01000
• LogP: -0.21620
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 191.069476538
• Heavy Atom Count: 14
• Complexity: 254

Purity/Quality:

99% ^*data from raw suppliers

3-(2-HYDROXYETHYL)-1,2,3-BENZOTRIAZIN-4(3H)-ONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)N(N=N2)CCO

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