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13138-78-8

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13138-78-8 Structure

13138-78-8 Structure
IdentificationBack Directory
[Name]

1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID
[CAS]

13138-78-8
[Synonyms]

IFLAB-BB F2124-0630
1-methyl-4-nitropyrrole-2-carboxylic Acid
1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID
1H-Pyrrole-2-carboxylic acid, 1-methyl-4-nitro-
[Molecular Formula]

C6H6N2O4
[MDL Number]

MFCD02180913
[MOL File]

13138-78-8.mol
[Molecular Weight]

170.12
Chemical PropertiesBack Directory
[Melting point ]

204 °C
[Boiling point ]

367.1±27.0 °C(Predicted)
[density ]

1.54±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

powder
[pka]

3.49±0.41(Predicted)
[BRN ]

168975
[InChI]

1S/C6H6N2O4/c1-7-3-4(8(11)12)2-5(7)6(9)10/h2-3H,1H3,(H,9,10)
[InChIKey]

GEGNYFQOFWUIFG-UHFFFAOYSA-N
[SMILES]

Cn1cc(cc1C(O)=O)[N+]([O-])=O
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P280-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

3
[Storage Class]

13 - Non Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

1-Methyl-4-nitropyrrole-2-carboxylic Acid is used in the synthesis of Lexitropsin and distamycin analogs with antimicrobial activities.
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