4-(1,3-Thiazol-4-yl)benzoic acid

Base Information

• Chemical Name: 4-(1,3-Thiazol-4-yl)benzoic acid
• CAS No.: 877758-98-0
• Molecular Formula: C10H7NO2S
• Molecular Weight: 205.23308
• European Community (EC) Number: 847-507-0
• DSSTox Substance ID: DTXSID90655821
• Wikidata: Q82570120
• ChEMBL ID: CHEMBL3452467

Synonyms:877758-98-0;4-(1,3-thiazol-4-yl)benzoic acid;4-(Thiazol-4-yl)benzoic acid;4-(4-carboxyphenyl)thiazole;4-(Thiazol-4-yl)benzoicacid;SCHEMBL600911;CHEMBL3452467;DTXSID90655821;CKB75898;AKOS009457045;EN300-104880;Z415646066;877674-95-8

Chemical Property of 4-(1,3-Thiazol-4-yl)benzoic acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 416.232°C at 760 mmHg
• Flash Point: 205.53°C
• Density: 1.369g/cm³
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 205.01974964
• Heavy Atom Count: 14
• Complexity: 214

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=CSC=N2)C(=O)O

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