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ChemicalBook--->CAS DataBase List--->6295-57-4

6295-57-4

6295-57-4 Structure

6295-57-4 Structure
IdentificationMore
[Name]

(2-BENZOTHIAZOLYLTHIO)ACETIC ACID
[CAS]

6295-57-4
[Synonyms]

(1,3-BENZOTHIAZOL-2-YLTHIO)ACETIC ACID
(2-BENZOTHIAZOLYLTHIO)ACETIC ACID
AKOS BB-8673
AKOS BBS-00002482
(BENZOTHIAZOL-2-YLSULFANYL)-ACETIC ACID
(BENZOTHIAZOL-2-YLTHIO)ACETIC ACID
BUTTPARK 122\02-97
OTAVA-BB BB0114090045
(2-benzothiazolylthio)-aceticaci
2-(carboxymethylthio)benzothiazole
(2-Benzothiazolythio)acetic acid
Acetic acid, (2-benzothiazolylthio)-(6CI,7CI,8CI,9CI)
Acetic acid,(2-benzothiazolylthio)-
2-[(Benzothiazole-2-yl)thio]acetic acid
[EINECS(EC#)]

228-565-0
[Molecular Formula]

C9H7NO2S2
[MDL Number]

MFCD00227391
[Molecular Weight]

225.29
[MOL File]

6295-57-4.mol
Chemical PropertiesBack Directory
[Melting point ]

159°C
[Boiling point ]

423.4±47.0 °C(Predicted)
[density ]

1.4374 (rough estimate)
[vapor pressure ]

0.001Pa at 20℃
[refractive index ]

1.5364 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Insoluble in water
[form ]

powder to crystal
[pka]

3.23±0.10(Predicted)
[color ]

White to Light yellow
[Water Solubility ]

133mg/L at 20℃
[InChI]

InChI=1S/C9H7NO2S2/c11-8(12)5-13-9-10-6-3-1-2-4-7(6)14-9/h1-4H,5H2,(H,11,12)
[InChIKey]

ZZUQWNYNSKJLPI-UHFFFAOYSA-N
[SMILES]

C(O)(=O)CSC1=NC2=CC=CC=C2S1
[LogP]

1.6 at 20℃
[CAS DataBase Reference]

6295-57-4(CAS DataBase Reference)
[EPA Substance Registry System]

Acetic acid, (2-benzothiazolylthio)- (6295-57-4)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[HazardClass ]

IRRITANT
[HS Code ]

2934208090
Hazard InformationBack Directory
[Uses]

(1,3-benzothiazol-2-ylthio)acetic acid is a useful research chemical.
Spectrum DetailBack Directory
[Spectrum Detail]

(2-BENZOTHIAZOLYLTHIO)ACETIC ACID(6295-57-4)MS
(2-BENZOTHIAZOLYLTHIO)ACETIC ACID(6295-57-4)1HNMR
(2-BENZOTHIAZOLYLTHIO)ACETIC ACID(6295-57-4)13CNMR
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

(2-Benzothiazolylthio)acetic Acid,>98.0%(T)(6295-57-4)
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