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439607-87-1

439607-87-1 structural image
Product Name: 5-BROMOBENZO[D]OXAZOLE-2-THIOL
Formula: C7H4BrNOS
Synonyms: 5-Bromo-2(3H)-benzoxazolethione
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SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H318:Serious eye damage/eye irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 230.08 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 228.91970 g/mol
Monoisotopic Mass 228.91970 g/mol
Topological Polar Surface Area 53.4 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 187
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