ChemicalBook--->CAS DataBase List--->40357-96-8

40357-96-8

40357-96-8 Structure

40357-96-8 Structure
IdentificationMore
[Name]

2-NITROTHIOPHENE-4-CARBOXYLIC ACID
[CAS]

40357-96-8
[Synonyms]

2-NITROTHIOPHENE-4-CARBOXYLIC ACID
5-NITROTHIOPHENE-3-CARBOXYLIC ACID
BUTTPARK 121\04-14
RARECHEM AL BO 1510
2-Nitrothiophene-4-carboxylic acid ,98%
[Molecular Formula]

C5H3NO4S
[MDL Number]

MFCD00052582
[Molecular Weight]

173.15
[MOL File]

40357-96-8.mol
Chemical PropertiesBack Directory
[Melting point ]

147 °C
[Boiling point ]

367.2±27.0 °C(Predicted)
[density ]

1.676±0.06 g/cm3(Predicted)
[storage temp. ]

Storage temp. 2-8°C
[form ]

solid
[pka]

3.16±0.10(Predicted)
[Appearance]

Light yellow to brown Solid
[Detection Methods]

HPLC
[InChI]

InChI=1S/C5H3NO4S/c7-5(8)3-1-4(6(9)10)11-2-3/h1-2H,(H,7,8)
[InChIKey]

VNJUNWUOAKEIKG-UHFFFAOYSA-N
[SMILES]

C1SC([N+]([O-])=O)=CC=1C(O)=O
[CAS DataBase Reference]

40357-96-8(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

WGK 3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29349990
[Storage Class]

11 - Combustible Solids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sulfuric acid-->Nitric acid-->3-Thiophenezoic acid
Hazard InformationBack Directory
[Chemical Properties]

Off-white solid
Spectrum DetailBack Directory
[Spectrum Detail]

2-NITROTHIOPHENE-4-CARBOXYLIC ACID(40357-96-8)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

5-nitrothiophene-3-carboxylic acid(40357-96-8)
[Alfa Aesar]

2-Nitrothiophene-4-carboxylic acid, 98%(40357-96-8)
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40357-96-8 609-40-5 6317-37-9