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17890-55-0

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17890-55-0 Structure

17890-55-0 Structure
IdentificationBack Directory
[Name]

ETHYL BENZO[B]THIOPHENE-2-CARBOXYLATE
[CAS]

17890-55-0
[Synonyms]

RARECHEM AL BI 0483
Ethyl 1-benzothiophene-2-carboxylate
ETHYL BENZO[B]THIOPHENE-2-CARBOXYLATE
1-benzothiophene-2-carboxylic acid ethyl ester
Benzo[b]thiophene-2-carboxylic acid ethyl ester
[Molecular Formula]

C11H10O2S
[MDL Number]

MFCD00116430
[MOL File]

17890-55-0.mol
[Molecular Weight]

206.26
Chemical PropertiesBack Directory
[Melting point ]

36-38 °C
[Boiling point ]

130 °C(Press: 0.15 Torr)
[density ]

1.231±0.06 g/cm3(Predicted)
[InChI]

InChI=1S/C11H10O2S/c1-2-13-11(12)10-7-8-5-3-4-6-9(8)14-10/h3-7H,2H2,1H3
[InChIKey]

PSLMIXGNCNQQRY-UHFFFAOYSA-N
[SMILES]

C12=CC=CC=C1C=C(C(OCC)=O)S2
Safety DataBack Directory
[HS Code ]

2934999090
Hazard InformationBack Directory
[Synthesis Reference(s)]

Synthetic Communications, 23, p. 743, 1993 DOI: 10.1080/00397919308009834
Synthesis, p. 58, 1978
Spectrum DetailBack Directory
[Spectrum Detail]

ETHYL BENZO[B]THIOPHENE-2-CARBOXYLATE(17890-55-0)1HNMR
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