2,6-Dibromoisonicotinic acid

Basic Information

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CAS Number

2016-99-1

Molecular Formula

C6H3Br2NO2

Molecular Weight

280.9 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Yellow to Brown Solid

Melting Point

170-173°C

Boiling Point

487.5℃ at 760 mmHg

SMILES

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C1=C(C=C(N=C1Br)Br)C(=O)O

InChI

InChI=1S/C6H3Br2NO2/c7-4-1-3(6(10)11)2-5(8)9-4/h1-2H,(H,10,11)

InChIKey

AULQTVXAKNKCCA-UHFFFAOYSA-N

LogP

2.3048

Topological Polar Surface Area

50.19 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

155

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

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

Synonyms & References

English

PS-4229
4-Pyridinecarboxylic acid, 2,6-dibromo-
DTXSID30573191
PB18991
AKOS005216798
CL0267
2,6-Dibromo-4-pyridinecarboxylic acid
FT-0647922
CS-W003630
A4397
SCHEMBL3443331
2,6-Dibromopyridine-4-carboxylicacid
AULQTVXAKNKCCA-UHFFFAOYSA-N
2016-99-1
2,6-Dibromoisonicotinic acid
2,6-dibromoisonicotinicacid
EN300-120315
Z1269137593
AMY10244
SY023715
2,6-Dibromo-isonicotinic acid
MFCD09743987
2,6-DIBROMOPYRIDINE-4-CARBOXYLIC ACID
AC-9594
2,6-Dibromopyridine-4-carboxylic acid
2,6-Dibrom-isonicotinsaeure
4-carboxy-2,6-dibromopyridine
2,6-dibromopyridine-4-carboxylic acid

MDL Number

MFCD09743987

FAQ

What regulatory guidelines apply to 2,6-Dibromoisonicotinic acid (CAS: 2016-99-1)?

2,6-Dibromoisonicotinic acid (CAS: 2016-99-1) is classified under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) as a skin and eye irritant. It must comply with REACH regulations for registration, evaluation, authorization, and restriction of chemicals. In the USA, it is regulated by the EPA and FDA for specific industrial and pharmaceutical uses.

Are there alternatives to 2,6-Dibromoisonicotinic acid (CAS: 2016-99-1) in synthesis?

For synthesis, you can consider using isomers or analogs such as 2-bromoisonicotinic acid or 6-bromoisonicotinic acid as alternatives. Common reagents like bromine or nitrous acid can be used as substitutes in the reaction pathways.

What is the market or research trend for 2,6-Dibromoisonicotinic acid (CAS: 2016-99-1)?

2,6-Dibromoisonicotinic acid (CAS: 2016-99-1) is increasingly being used in pharmaceutical research for its potential in the development of anti-inflammatory and anti-tumor drugs. Market trends show growing interest in its application as a precursor for various chemical syntheses.

How should waste containing 2,6-Dibromoisonicotinic acid (CAS: 2016-99-1) be handled?

Waste containing 2,6-Dibromoisonicotinic acid (CAS: 2016-99-1) should be collected in appropriate containers and disposed of by incineration or professional waste disposal services. Proper environmental protection measures are essential to prevent contamination. Follow local and international regulations for hazardous waste management.