tris-hydroxymethylnitromethane
isobutylglycerol, nitro-
Identification
| Name | tris-hydroxymethylnitromethane |
| IUPAC | 2-(hydroxymethyl)-2-nitropropane-1,3-diol |
| CAS Number | 126-11-4 |
| EINECS | 204-769-5 |
| FDA UNII | 3E794G4ZRB |
| Molecular Formula | C4 H9 N O5 |
| Molecular Weight | 151.11873000 |
| MDL Number | MFCD00007395 |
| Nikkaji Number | J2.509G |
| Beilstein | 1768985 |
Regulatory
Physical Properties
| Appearance | white solid (est) |
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Melting Point | 165.00 °C. @ 760.00 mm Hg |
| Boiling Point | 445.60 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure | 3.200000 mmHg @ 25.00 °C. (est) |
| Flash Point | 409.00 °F. TCC ( 209.30 °C. ) (est) |
| logP (o/w) | 0.350 (est) |
| Soluble in | water, 2.20E+06 mg/L @ 20 °C (exp) |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | antimicrobial agents |
No sensory data available
Safety Information
| Preferred SDS | View |
| Oral/Parenteral Toxicity | intraperitoneal-mouse LD50 4000 mg/kg |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | antimicrobial agents |
| Recommendation for tris-hydroxymethylnitromethane usage levels up to | not for fragrance use. |
| Recommendation for tris-hydroxymethylnitromethane flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
iso
butylglycerol, nitro-
cimcool wafers
2-
hydroxymethyl-2-nitropropane-1,3-diol
tris(
hydroxymethyl) nitromethane
2-(
hydroxymethyl)-2-nitro-1,3-propanediol
2-(
hydroxymethyl)-2-nitropropane-1,3-diol
2-(
hydroxymethyl)-2-nitropropanediol
1,1,1-tris(
hydroxymethyl)nitromethane
tris(
hydroxymethyl)nitromethane
methane, trimethylolnitro-
2-
nitro-2-(hydroxymethyl)-1,3-propanediol
nitroisobutylglycerol
nitromethylidynetrimethanol
nitrotris(hydroxymethyl)methane
trihydroxymethylnitromethane
trimethylolnitromethane
tris nitro
PubMed:
Aliphatic β-nitroalcohols for therapeutic corneoscleral cross-linking: chemical stability studies using 1H-NMR spectroscopy.
PubMed:
Aliphatic β-nitroalcohols for therapeutic corneoscleral cross-linking: corneal permeability considerations.
PubMed:
Aliphatic beta-nitroalcohols for therapeutic corneoscleral cross-linking: chemical mechanisms and higher order nitroalcohols.
PubMed:
Unprecedented selective ipso-nitration of calixarenes monitored by the O-substituents.
PubMed:
Allergic contact dermatitis in two machinists.
PubMed:
Isolation of an enzyme from soil that degrades the organophosphorus insecticide, crotoxyphos.