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2-(2-Thiophenecarboxy)benzoic acid

HCID 65838
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
95232-68-1
Standard SMILES
O=C(Oc1ccccc1C(=O)O)c1cccs1
InChIKey
JCUTZUSPPNNLDC-UHFFFAOYSA-N
Molecular formula
C12H8O4S
Average molar mass
248.26 g/mol
Monoisotopic mass
248.01432991

Overview

Tenosal is a small molecule drug. Tenosal has a monoisotopic molecular weight of 248.01 Da.

Names & identifiers

Preferred name
2-(2-Thiophenecarboxy)benzoic acid
IUPAC
2-(thiophene-2-carbonyloxy)benzoic acid
English name
Tenosal
Molecular formula
C12H8O4S
Molecular weight
248.257

Names & synonyms

2-(2-Thiophenecarboxy)benzoic acidYS-1342-Thiophenecarboxylic acid, 2-carboxyphenyl esterRefChem:187857Tenosal95232-68-12-(thiophene-2-carbonyloxy)benzoic acidTenosal [INN]EEK88K197TTenosalumTenosalum [INN-Latin]UNII-EEK88K197T
Show more names
SCHEMBL1876202-Thiophenecarboxylic acid, ester with salicylic acidorb1708385CHEMBL2107494DTXSID80241792MFCD00866162YS 134AKOS005359610

Database identifiers

CAS
95232-68-1
PubChem CID
65838
DTXSID
DTXSID80241792
ChEMBL
CHEMBL2107494
UNII
EEK88K197T
Nikkaji
J326.063A

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
91.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
305

Physicochemical properties

storage temp.
-20 °C · Store at -20°C
solubility
Soluble in DMSO
FDA UNII
88 K197T · EEK88K197T
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

UsesTenosal is a new compound obtained by esterifying salicylic acid with 2-thiophene-carboxylic acid and displays anti-inflammatory, analgesic and antipyretic properties.

Suppliers9 total

上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
上海凯裕医药科技有限公司17317130613 · [email protected]
TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
济南九黎生物科技有限公司15865264761 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes