4-(Thiophen-2-yl)benzoic acid

Base Information

• Chemical Name: 4-(Thiophen-2-yl)benzoic acid
• CAS No.: 300816-11-9
• Molecular Formula: C16H14 N2 O4
• Molecular Weight: 298.29336
• European Community (EC) Number: 630-253-8
• DSSTox Substance ID: DTXSID20952491
• Nikkaji Number: J763.135I
• Wikidata: Q82931102
• ChEMBL ID: CHEMBL1922555
• Mol file: 300816-11-9.mol

Synonyms:4-(Thiophen-2-yl)benzoic acid;29886-62-2;4-(2-Thienyl)benzoic acid;4-thiophen-2-yl-benzoic acid;4-Thiophen-2-ylbenzoic acid;Benzoic acid, 4-(2-thienyl)-;4-(Thien-2-yl)benzoic acid;SDCCGMLS-0065960.P001;4-thien-2-ylbenzoic acid;SCHEMBL420705;CHEMBL1922555;4-(thiophen-2-yl)-benzoic acid;DTXSID20952491;CVDUBQJEQNRCIZ-UHFFFAOYSA-N;MFCD00690742;STK027502;AKOS000124479;AS-2092;4-(Thiophen-2-yl)benzoic acid, 97%;AM20060601;BB 0222397;FT-0616565;EN300-100457;A820181;J-513346;F9995-2722

Chemical Property of 4-(Thiophen-2-yl)benzoic acid

Chemical Property:

• Melting Point: 171-172℃
• PSA: 88.40000
• LogP: 1.62920
• Storage Temp.: −20°C
• Sensitive.: Light Sensitive
• Solubility.: ≤2mg/ml in DMSO;2mg/ml in dimethyl formamide
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 204.02450067
• Heavy Atom Count: 14
• Complexity: 209

Purity/Quality:

98%min ^*data from raw suppliers

Nullscript ≥98% ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CSC(=C1)C2=CC=C(C=C2)C(=O)O