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4-{[(3-Methyl-2-thienyl)methyl]amino}benzoic acid
[CAS# 869950-51-6]

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Identification
Name 4-{[(3-Methyl-2-thienyl)methyl]amino}benzoic acid
Synonyms 4-[(3-Methyl-thiophen-2-ylmethyl)-amino]-benzoic acid; 4-{[(3-methylthien-2-yl)methyl]amino}benzoic acid; 4-{[(3-methylthiophen-2-yl)methyl]amino}benzoic acid
Molecular Structure CAS#: 869950-51-6, 4-{[(3-Methyl-2-thienyl)methyl]amino}benzoic acid
Molecular Formula C13H13NO2S
Molecular Weight 247.31
CAS Registry Number 869950-51-6
SMILES O=C(O)c2ccc(NCc1sccc1C)cc2
InChI 1S/C13H13NO2S/c1-9-6-7-17-12(9)8-14-11-4-2-10(3-5-11)13(15)16/h2-7,14H,8H2,1H3,(H,15,16)
InChIKey PVOPXJDFVBSJES-UHFFFAOYSA-N
Properties
Density 1.316g/cm3 (Cal.)
Boiling point 435.24°C at 760 mmHg (Cal.)
Flash point 217.025°C (Cal.)
Refractive index 1.674 (Cal.)
Market Analysis Reports
List of Reports Available for 4-{[(3-Methyl-2-thienyl)methyl]amino}benzoic acid
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