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113850-96-7

113850-96-7 structural image
Product Name: 7-BROMO-4-OXO-4H-CHROMENE-2-CARBOXYLIC ACID
Formula: C10H5BrO4
Synonyms: 7-Bromo-4-oxo-4H-1-benzopyran-2-carboxylic acid;7-Bromo-4-oxo-4H-chromene-2-carboxylic acid
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 269.05 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 267.93712 g/mol
Monoisotopic Mass 267.93712 g/mol
Topological Polar Surface Area 63.6 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 336
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