2-Bromo-2-nitro-1,3-propanediol

Basic Information

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CAS Number

52-51-7

Molecular Formula

C3H6BrNO4

Molecular Weight

199.99 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Water Treatment Chemicals Disinfectants Chlorine Compounds

Basic Physical Properties

Melting Point

130-133?°C

Boiling Point

358°C at 760 mmHg

Water Solubility

25 g/100 mL (22 oC)

Flash Point

167°C

Solubility

H2O: soluble100mg/mL, clear, colorless to faintly yellow

Refractive Index

1.574

Vapor Pressure

1.45E-06mmHg at 25°C

SMILES

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OCC(Br)(CO)[N+](=O)[O-]

InChI

InChI=1S/C3H6BrNO4/c4-3(1-6,2-7)5(8)9/h6-7H,1-2H2

InChIKey

LVDKZNITIUWNER-UHFFFAOYSA-N

LogP

-0.13790

Complexity

107

Safety Information

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GHS Hazard Pictograms

H302

H312

H315

H318

H335

H400

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H315 Causes skin irritation
Skin corrosion/irritation

H318 Causes serious eye damage
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

H400 Very toxic to aquatic life
Hazardous to the aquatic environment, acute hazard

Hazard Class

Class 4.1 Class 4.1

Stability

Stable. Hygroscopic. Incompatible with strong oxidizing agents, strong bases, strong reducing agents, acid chlorides and anhydrides, moisture.

Toxicity

LD50 in mice, rats (mg/kg): 350, 400 orally (Croshaw)

Synonyms & References

English

2-Bromo-2-nitro-1,3-propanediol
Bronopol
2-Bromo-2-nitropropane-1,3-diol
1,3-Propanediol, 2-bromo-2-nitro-
2-Bromo-1-nitro-1,3-propanediol
2-bromo-2-nitro-3-propanediol
2-Bromo-2-nitropropan-1,3-diol
2-Nitro-2-bromo-1,3-propanediol
3-Propanediol,2-bromo-2-nitro-1
beta-Bromo-beta-nitrotrimethyleneglycol
Bioban BNPD-40
2-BROMO-2-NITRO-1,3-PROPANDIOL
2-Bromo-2-nitro-1,3-propanediolneat
Bronopol Solution
DBNPA-10
DBNPA-20
2-Bromo-2-nitropropane-1,3-diol (Bronopol)
BNPD
BNPK
溴硝醇（布罗波尔）
2-bromo-2-nitropropane-1,3-diol

MDL Number

MFCD00007390

Customs Code

2905590030

FAQ

What is 2-Bromo-2-nitro-1,3-propanediol (CAS: 52-51-7)?

2-Bromo-2-nitro-1,3-propanediol is a chemical compound with the CAS number 52-51-7. It has the molecular formula C3H7BrNO4 and is characterized by its bromine and nitro groups attached to the propane diol backbone. This compound is known for its complex structure and is often used in specialized chemical applications due to its reactivity and functional groups.

What are the main uses of 2-Bromo-2-nitro-1,3-propanediol (CAS: 52-51-7)?

2-Bromo-2-nitro-1,3-propanediol is primarily used in pharmaceutical research as an intermediate in the synthesis of various drugs. It also finds application in organic chemistry for the development of new compounds and in industrial processes involving functional group transformations. Its unique properties make it valuable in research and specialty chemical manufacturing.

Is 2-Bromo-2-nitro-1,3-propanediol (CAS: 52-51-7) safe?

2-Bromo-2-nitro-1,3-propanediol is considered hazardous due to its potential toxicity. It should be handled with appropriate protective measures, including gloves, goggles, and a fume hood. Safety standards recommend avoiding inhalation, ingestion, and skin contact. Always follow OSHA and EPA guidelines when working with this compound.

How should 2-Bromo-2-nitro-1,3-propanediol (CAS: 52-51-7) be stored?

2-Bromo-2-nitro-1,3-propanediol should be stored in a cool, dry, and dark place, away from heat and light. It is typically kept in a sealed container to prevent moisture absorption. Storage conditions should maintain a temperature below 25°C and humidity levels below 60%. Always store in a well-ventilated area to ensure safety.