ChemicalBook--->CAS DataBase List--->101861-40-9

101861-40-9

101861-40-9 Structure

101861-40-9 Structure
IdentificationBack Directory
[Name]

AKOS B029968
[CAS]

101861-40-9
[Synonyms]

AKOS B029968
VITAS-BB TBB010226
CHEMBRDG-BB 5119137
ART-CHEM-BB B029968
5-(ETHYLTHIO)THIOPHENE-2-CARBOXYLIC ACID
2-Thiophenecarboxylic acid, 5-(ethylthio)-
5-ETHYLSULFANYL-THIOPHENE-2-CARBOXYLIC ACID
5-(ethylthio)thiophene-2-carboxylic acid(SALTDATA: FREE)
[Molecular Formula]

C7H8O2S2
[MDL Number]

MFCD00738671
[MOL File]

101861-40-9.mol
[Molecular Weight]

188.27
Chemical PropertiesBack Directory
[Melting point ]

66.5-67 °C
[Boiling point ]

345.6±27.0 °C(Predicted)
[density ]

1.36±0.1 g/cm3(Predicted)
[form ]

solid
[pka]

3.60±0.10(Predicted)
[InChI]

1S/C7H8O2S2/c1-2-10-6-4-3-5(11-6)7(8)9/h3-4H,2H2,1H3,(H,8,9)
[InChIKey]

JELCXTWBBLAQMG-UHFFFAOYSA-N
[SMILES]

CCSc1ccc(s1)C(O)=O
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

38
[WGK Germany ]

3
[Storage Class]

13 - Non Combustible Solids
[Hazard Classifications]

Skin Irrit. 2
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