2-bromo-2-nitropropane-1,3-diol
C3H6BrNO4
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Identification
- CAS Number
- 52-51-7
- EC Number
- 200-143-0
- UN Number
- 3241
- Index Number
- 603-085-00-8
- PubChem CID
- 2450
Physical-chemical properties
- Molecular Formula
- C3H6BrNO4
- Molar Mass
- 199.99 g/mol
- IUPAC Name
- 2-bromo-2-nitropropane-1,3-diol
Chemical Identifiers
- InChI
- InChI=1S/C3H6BrNO4/c4-3(1-6,2-7)5(8)9/h6-7H,1-2H2
- InChI Key
- LVDKZNITIUWNER-UHFFFAOYSA-N
Overview
2-bromo-2-nitropropane-1,3-diol (CAS 52-51-7) is a halogenated nitro compound with antimicrobial properties and industrial biocide applications. This versatile chemical compound, also known by its EC number 200-143-0, features a unique molecular structure combining bromine and nitro functional groups with dual hydroxyl substituents. With a molecular formula of C3H6BrNO4 and molecular weight of 199.99 g/mol, this crystalline substance exhibits distinctive chemical reactivity patterns that make it valuable across multiple industrial sectors. The compound presents significant safety considerations, classified under ADR Class 4.1 as a flammable solid. Its hazard profile includes acute toxicity (Category 4), skin irritation potential, serious eye damage risks, and aquatic toxicity concerns, requiring careful handling protocols. The GHS pictograms GHS07, GHS05, and GHS09 emphasize the need for appropriate personal protective equipment and environmental precautions during use. Primary industrial applications center around its antimicrobial efficacy, particularly in water treatment systems, metalworking fluid preservation, and specialized coating formulations. The compound's biocidal properties make it effective against bacteria, fungi, and algae in industrial processes. Unlike related compounds such as 4-nitrosophenol which serves different industrial functions, 2-bromo-2-nitropropane-1,3-diol specifically targets microbial control applications where halogenated biocides are preferred. Manufacturing facilities utilizing this compound benefit from its stability under controlled conditions and compatibility with various industrial formulations. Quality control laboratories also employ it in analytical procedures requiring precise antimicrobial standards. OYSI maintains reliable supplies of 2-bromo-2-nitropropane-1,3-diol for European industrial customers, ensuring consistent quality and regulatory compliance.
Safety & Classification
Acute Tox. 4 *; Acute Tox. 4 *; STOT SE 3; Skin Irrit. 2; Eye Dam. 1; Aquatic Acute 1
GHS Pictograms
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).
First Aid Measures
Inhalation
Measures if vapours or dust are inhaled
First Aid Actions
- +P304IF INHALED:
- +P340Remove person to fresh air and keep comfortable for breathing.
- +P311Call a POISON CENTER/doctor.
Related hazard statements:
Skin Contact
Measures if substance contacts the skin
Eye Contact
Measures if substance gets into the eyes
First Aid Actions
- +P305IF IN EYES:
- +P351Rinse cautiously with water for several minutes.
- +P338Remove contact lenses, if present and easy to do. Continue rinsing.
- +P313Get medical advice/attention.
Related hazard statements:
Ingestion
Measures if substance is accidentally swallowed
First Aid Actions
- +P301IF SWALLOWED:
- +P330Rinse mouth.
- +P331Do NOT induce vomiting.
- +P310Immediately call a POISON CENTER/doctor.
Related hazard statements:
General Measures
Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)
First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.
Transport (ADR)
| UN Number | 3241 |
| ADR Class | 4.1 |
| Packing Group | III |
| Tunnel Code | D |
| Proper Shipping Name | 2-Brom-2-nitropropan-1,3-diol |
| Marine Pollutant | No |
Frequently Asked Questions
What is 2-bromo-2-nitropropane-1,3-diol?
2-bromo-2-nitropropane-1,3-diol is an antimicrobial compound with the molecular formula C3H6BrNO4 and CAS number 52-51-7. This chemical substance has a molecular weight of 199.99 g/mol and contains both bromine and nitro functional groups attached to a propane backbone with two hydroxyl groups. It is classified as a hazardous substance with multiple danger classifications including acute toxicity, skin irritation, and eye damage potential.
What are the physicochemical properties of 2-bromo-2-nitropropane-1,3-diol?
2-bromo-2-nitropropane-1,3-diol is a crystalline solid at room temperature with good water solubility due to its hydroxyl groups. The compound appears as white to off-white crystals and is stable under normal storage conditions. Its molecular structure combines hydrophilic hydroxyl groups with halogenated and nitro functionalities, making it effective as a preservative while maintaining reasonable water solubility for various applications.
What is 2-bromo-2-nitropropane-1,3-diol used for?
2-bromo-2-nitropropane-1,3-diol is primarily used as a broad-spectrum antimicrobial preservative in cosmetic and personal care products. It effectively inhibits the growth of bacteria, yeasts, and molds in water-based formulations such as shampoos, conditioners, and skin care products. The compound is particularly valued for its stability and effectiveness at low concentrations, making it suitable for pH-sensitive formulations where other preservatives may be less effective.
How to handle 2-bromo-2-nitropropane-1,3-diol safely?
2-bromo-2-nitropropane-1,3-diol requires careful handling with appropriate personal protective equipment including safety goggles, chemical-resistant gloves, and protective clothing. Work should be conducted in well-ventilated areas or under fume extraction systems. Avoid direct skin and eye contact, and prevent inhalation of dust particles. The substance is classified as Acute Tox. 4, Skin Irrit. 2, and Eye Dam. 1, requiring strict adherence to safety protocols during use.
How to store 2-bromo-2-nitropropane-1,3-diol correctly?
2-bromo-2-nitropropane-1,3-diol should be stored in a cool, dry, well-ventilated area away from heat sources and direct sunlight. Keep containers tightly closed and store in original packaging. Avoid storage near strong reducing agents, alkalis, and combustible materials. The storage area should be equipped with appropriate spill containment measures and maintained at stable temperatures to prevent degradation of the compound.
What to do in case of contact with 2-bromo-2-nitropropane-1,3-diol?
2-bromo-2-nitropropane-1,3-diol contact requires immediate action: for skin contact, wash thoroughly with soap and water for at least 15 minutes. For eye contact, rinse immediately with clean water for at least 15 minutes and seek medical attention due to the Eye Dam. 1 classification. If inhaled, move to fresh air immediately. Remove contaminated clothing and wash before reuse. Seek medical attention if irritation persists or if significant exposure has occurred.
How to dispose of 2-bromo-2-nitropropane-1,3-diol appropriately?
2-bromo-2-nitropropane-1,3-diol must be disposed of according to local and national hazardous waste regulations. The compound cannot be disposed of with regular waste due to its hazard classifications and environmental impact (Aquatic Acute 1). Contact licensed hazardous waste disposal companies for proper collection and treatment. Empty containers should also be handled as hazardous waste and never be reused for other purposes without proper decontamination procedures.
How to transport 2-bromo-2-nitropropane-1,3-diol?
2-bromo-2-nitropropane-1,3-diol is classified under ADR as Class 4.1 (Flammable solids), Packing Group III for transportation purposes. Packages must comply with UN packaging requirements and be properly labeled with hazard pictogrammes and transport documentation. Vehicles must carry appropriate safety equipment and emergency response information. Only qualified personnel should handle transportation, ensuring compliance with international dangerous goods regulations and proper segregation from incompatible materials.
Is 2-bromo-2-nitropropane-1,3-diol subject to specific regulations?
2-bromo-2-nitropropane-1,3-diol is subject to REACH regulation requiring registration for import/manufacture above 1 tonne annually. It is not currently listed as an SVHC substance but must comply with CLP regulation for classification and labeling. The substance requires safety data sheets and appropriate hazard communication. Additionally, its use in cosmetic products is regulated under the EU Cosmetic Regulation, with specific concentration limits and usage restrictions that must be observed.
Where to buy 2-bromo-2-nitropropane-1,3-diol in Europe?
2-bromo-2-nitropropane-1,3-diol is available through OYSI, a specialized European distributor of technical chemicals and industrial raw materials. OYSI provides this preservative to professional users across Europe with proper documentation, safety data sheets, and regulatory compliance support. As a restricted chemical requiring careful handling and regulatory compliance, it is only supplied to qualified industrial users and cosmetic manufacturers with appropriate facilities and expertise.
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2-bromo-2-nitropropane-1,3-diol is a dangerous good. We support you with labeling, packaging, and transport documentation.
Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.