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2131-64-8

2131-64-8 structural image
Product Name: 4-(DIMETHYLAMINO)PHENYL ISOTHIOCYANATE
Formula: C9H10N2S
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Corrosion
Corrosives
GHS05

Skull and Crossbones
Acute Toxicity
GHS06
GHS Hazard Statements H300:Acute toxicity,oral
H310:Acute toxicity,dermal
H314:Skin corrosion/irritation
H318:Serious eye damage/eye irritation
H330:Acute toxicity,inhalation
Precautionary Statement Codes P320:Specific treatment is urgent (see … on this label).
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405:Store locked up.

COMPUTED DESCRIPTORS

Molecular Weight 178.26 g/mol
XLogP3 4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 178.05646950 g/mol
Monoisotopic Mass 178.05646950 g/mol
Topological Polar Surface Area 47.7 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 177
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