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ChemicalBook--->CAS DataBase List--->618-88-2

618-88-2

618-88-2 Structure

618-88-2 Structure
IdentificationMore
[Name]

5-Nitroisophthalic acid
[CAS]

618-88-2
[Synonyms]

3-NITRO-5-CARBOXYLIC ACID BENZOIC ACID
5-nitro-1,3-benzenedicarboxylic acid
5-NITROBENZENE-1,3-DICARBOXYLIC ACID
5-NITROISOPHTHALIC ACID
NITROISOPHTHALIC-5 ACID
NITRO ISOPHTHALIC ACID
5-nitro-3-benzenedicarboxylicacid
5-NIPA
5-NITRO-ISO-PHTHALIC ACID PESTANAL
5itroIsophathalicAcid
1,3-BENZENEDICARBOXYLIC ACID,5-NITRO
5-NITROISOPHTHALIC ACID 99+%
5-NITROISOPHTHALIC ACID5-NITRO-PHENYL-1,3-DICARBOXYLIC ACID
5-Nitro-m-phthalic acid
[EINECS(EC#)]

210-568-3
[Molecular Formula]

C8H5NO6
[MDL Number]

MFCD00007254
[Molecular Weight]

211.13
[MOL File]

618-88-2.mol
Chemical PropertiesBack Directory
[Appearance]

LIGHT CREAM CRYSTALLINE POWDER
[Melting point ]

259-261 °C(lit.)
[Boiling point ]

350.79°C (rough estimate)
[density ]

1.6342 (rough estimate)
[vapor pressure ]

0Pa at 25℃
[refractive index ]

1.5282 (estimate)
[Fp ]

120°C
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Acetonitrile (Slightly, Heated), DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

2.81±0.10(Predicted)
[color ]

White to Off-White
[Water Solubility ]

Soluble in water.1.5 g/L at 20°C
[BRN ]

1976587
[LogP]

1.1 at 25℃
[CAS DataBase Reference]

618-88-2(CAS DataBase Reference)
[EPA Substance Registry System]

618-88-2(EPA Substance)
Questions And AnswerBack Directory
[Uses]

5-Nitrobenzene-1,3-Dicarboxylic Acid is used in the synthesis of Glycopyrrolate, a novel pharmaceutical compound based on PDE IV inhibitors; used in the treatment of respiratory complaints. Also used in the synthesis of coordination polymers.
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R40:Limited evidence of a carcinogenic effect.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S22:Do not breathe dust .
[RIDADR ]

2811
[WGK Germany ]

3
[TSCA ]

Yes
[HS Code ]

29173990
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Nitric acid-->Isophthalic acid-->Nitroxylol-->3-Methyl-5-nitrobenzoic acid-->4-NITROISOPHTHALIC ACID
[Preparation Products]

5-AMINO-N-METHYLISOPHTHALAMIC ACID-->Dimethyl 5-nitroisophthalate-->5-Amino-2,4,6-triiodoisophthaloyl dichloride-->Dimethyl 5-aminoisophthalate-->5-Amino-2,4,6-triiodoisophthalic acid-->Iopamidol-->3,5-Bis(trifluoromethyl)nitrobenzene-->Methyl 5-nitroisophthalate-->DIETHYL 5-AMINOISOPHTHALATE HYDROCHLORIDE
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

5-Nitroisophthalic acid(618-88-2).msds
Hazard InformationBack Directory
[Chemical Properties]

LIGHT CREAM CRYSTALLINE POWDER
[Flammability and Explosibility]

Nonflammable
Spectrum DetailBack Directory
[Spectrum Detail]

5-Nitroisophthalic acid(618-88-2)MS
5-Nitroisophthalic acid(618-88-2)1HNMR
5-Nitroisophthalic acid(618-88-2)13CNMR
5-Nitroisophthalic acid(618-88-2)IR1
5-Nitroisophthalic acid(618-88-2)IR2
5-Nitroisophthalic acid(618-88-2)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

5-Nitroisophthalic acid, 98%(618-88-2)
[Alfa Aesar]

5-Nitroisophthalic acid, 98%(618-88-2)
[Sigma Aldrich]

618-88-2(sigmaaldrich)
[TCI AMERICA]

5-Nitroisophthalic Acid,>99.0%(LC)(T)(618-88-2)
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