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2157-39-3

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2157-39-3 Structure

2157-39-3 Structure
IdentificationBack Directory
[Name]

5-chloroisophthalic acid
[CAS]

2157-39-3
[Synonyms]

5-chloroisophthalic acid
5-Chloro-1,3-benzenedicarboxylic acid
5-chlorobenzene-1,3-dicarboxylic acid
1,3-Benzenedicarboxylic acid, 5-chloro-
[EINECS(EC#)]

218-468-1
[Molecular Formula]

C8H5ClO4
[MOL File]

2157-39-3.mol
[Molecular Weight]

200.58
Chemical PropertiesBack Directory
[Melting point ]

279-280 °C
[Boiling point ]

424.5±30.0 °C(Predicted)
[density ]

1.586±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

3.16±0.10(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C8H5ClO4/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3H,(H,10,11)(H,12,13)
[InChIKey]

PLPFTLXIQQYOMW-UHFFFAOYSA-N
[SMILES]

C1(C(O)=O)=CC(Cl)=CC(C(O)=O)=C1
[EPA Substance Registry System]

1,3-Benzenedicarboxylic acid, 5-chloro- (2157-39-3)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352-P305+P351+P338
[TSCA ]

TSCA listed
Spectrum DetailBack Directory
[Spectrum Detail]

5-chloroisophthalic acid(2157-39-3)1HNMR
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