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7612-98-8

7612-98-8 structural image
Product Name: 4-(N,N-DIMETHYLAMINO)AZOBENZENE-4'-ISOTHIOCYANATE
Formula: C15H14N4S
Synonyms: 4-(Dimethylamino)azobenzene-4′-isothiocyanate;DABITC
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SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Health Hazard
GHS08
GHS Hazard Statements H317:Sensitisation, Skin
H334:Sensitisation, respiratory
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P342+P311:IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician.

COMPUTED DESCRIPTORS

Molecular Weight 282.4 g/mol
XLogP3 5.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 282.09391764 g/mol
Monoisotopic Mass 282.09391764 g/mol
Topological Polar Surface Area 72.4 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 360
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