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1466-48-4

1466-48-4 structural image
Product Name: 1,1,1-TRIS(2-CYANOETHYL)NITROMETHANE
Formula: C10H12N4O2
Synonyms: 3,3′,3″-(Nitromethylidyne)tripropionitrile;4-(2-Cyanoethyl)-4-nitroheptanedinitrile;4-(2-Cyanoethyl)-4-nitropimelonitrile;Nitromethanetrispropionitrile;Nitro-tris(2-cyanoethyl)methane
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
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 220.23 g/mol
XLogP3 0
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 220.09602564 g/mol
Monoisotopic Mass 220.09602564 g/mol
Topological Polar Surface Area 117 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 333
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