2-(1,3-Benzothiazol-2-YL)acetaldehyde

Base Information

• Chemical Name: 2-(1,3-Benzothiazol-2-YL)acetaldehyde
• CAS No.: 106086-77-5
• Molecular Formula: C9H7 N O S
• Molecular Weight: 177.22
• DSSTox Substance ID: DTXSID20545125
• Wikidata: Q82422514
• Mol file: 106086-77-5.mol

Synonyms:106086-77-5;2-(1,3-BENZOTHIAZOL-2-YL)ACETALDEHYDE;2-Benzothiazoleacetaldehyde(9CI);2-(BENZO[D]THIAZOL-2-YL)ACETALDEHYDE;SCHEMBL620659;DTXSID20545125;(1,3-Benzothiazol-2-yl)acetaldehyde;AKOS017518701;AB66110;EN300-1851064

Chemical Property of 2-(1,3-Benzothiazol-2-YL)acetaldehyde

Chemical Property:

• PSA: 58.20000
• LogP: 2.03770
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 177.02483502
• Heavy Atom Count: 12
• Complexity: 174

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=C(S2)CC=O