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126-11-4

126-11-4 structural image
Product Name: Tris(hydroxymethyl)nitromethane
Formula: C4H9NO5
Synonyms: 2-Hydroxymethyl-2-nitro-1,3-propanediol
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid
Color/Form Crystals from ethyl acetate and benzene
Odor Odorless
Melting Point 214 °C (pure)
Solubility Soluble in polar solvents such as methanol and isopropanol. Insoluble in non-polar solvents such as aliphatic and aromatic hydrocarbons.
Vapor Pressure 0.00000154 [mmHg]
Stability/Shelf Life /2-(hydroxymethyl)-2-nitro-1,3-propanediol/ is stable only under acidic conditions of pH 5.0 and below, and is unstable and decomposes to formaldehyde under alkaline conditions and at temperatures above 49 °C.
Decomposition When heated to decomposition it emits toxic fumes of /nitrogen oxide/.
Chemical Classes Other Uses -> Biocides/Disinfectants

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H412:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P273:Avoid release to the environment.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 151.12 g/mol
XLogP3 -2.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 151.04807239 g/mol
Monoisotopic Mass 151.04807239 g/mol
Topological Polar Surface Area 107 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 107
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

RELATED SUPPLIERS

Speciality Organics Pvt. Ltd.

1Y
product:126-11-4 Tris-(hydroxymethyl)-nitromethane 98%
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