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6960-45-8

6960-45-8 structural image
Product Name: 7-Nitroindole-2-carboxylic acid
Formula: C9H6N2O4
Synonyms: 7-Nitro-1H-indole-2-carboxylic acid;7-Nitroindole-2carboxylic acid;7-Nitroindole-2-carboxylic acid, CRT0044876;DNA Base Excision Repair Pathway Inhibitor - CAS 6960-45-8 - Calbiochem;NSC 69877
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SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Health Hazard
GHS08
GHS Hazard Statements H319:Serious eye damage/eye irritation
H334:Sensitisation, respiratory
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P342+P311:IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician.

COMPUTED DESCRIPTORS

Molecular Weight 206.15 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 206.03275668 g/mol
Monoisotopic Mass 206.03275668 g/mol
Topological Polar Surface Area 98.9 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 288
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes