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102539-79-7

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102539-79-7 Structure

102539-79-7 Structure
IdentificationBack Directory
[Name]

6-METHOXY-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID
[CAS]

102539-79-7
[Synonyms]

6-methoxy-2-benzothiophenecarboxylic acid
6-Methoxy-1-benzothiophene-2-carboxylic acid
6-METHOXY-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID
Benzo[b]thiophene-2-carboxylic acid, 6-Methoxy-
[Molecular Formula]

C10H8O3S
[MDL Number]

MFCD07371542
[MOL File]

102539-79-7.mol
[Molecular Weight]

208.23
Chemical PropertiesBack Directory
[Melting point ]

248.5-249 °C(Solv: acetone (67-64-1); benzene (71-43-2))
[Boiling point ]

410.0±25.0 °C(Predicted)
[density ]

1.392±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[pka]

3.58±0.30(Predicted)
[InChI]

InChI=1S/C10H8O3S/c1-13-7-3-2-6-4-9(10(11)12)14-8(6)5-7/h2-5H,1H3,(H,11,12)
[InChIKey]

XTXMOIBADXDEKF-UHFFFAOYSA-N
[SMILES]

C12=CC(OC)=CC=C1C=C(C(O)=O)S2
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319-H335-H302+H312+H332-H315
[Precautionary statements ]

P301+P312-P362+P364-P280
[HS Code ]

2932990090
Spectrum DetailBack Directory
[Spectrum Detail]

6-METHOXY-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID(102539-79-7)1HNMR
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