Methyl 5-bromo-2-iodobenzoate

Basic Information

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CAS Number

181765-86-6

Molecular Formula

C8H6BrIO2

Molecular Weight

340.94 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

43.0 to 47.0 deg-C

Boiling Point

134°C/1mmHg

SMILES

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COC(=O)C1=C(C=CC(=C1)Br)I

InChI

InChI=1S/C8H6BrIO2/c1-12-8(11)6-4-5(9)2-3-7(6)10/h2-4H,1H3

InChIKey

CJRHLSZJEFJDLA-UHFFFAOYSA-N

LogP

2.840300000000001

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

174

Safety Information

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Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

SCHEMBL154632
AKOS015834747
A20186
J-011626
Methyl5-bromo-2-iodobenzoate
MFCD00144771
Benzoic acid, 5-bromo-2-iodo-, methyl ester
AM20030203
181765-86-6
CJRHLSZJEFJDLA-UHFFFAOYSA-N
FT-0699824
Methyl 5-bromo-2-iodobenzoate, 97%
Methyl 5-bromo-2-iodobenzoate
SY015039
5-BROMO-2-IODOBENZOIC ACID METHYL ESTER
M3084
PS-7010
DTXSID50454453
CS-W018330
METHYL 5-BROMO-2-IODOBENZOATE
Benzoic acid,5-bromo-2-iodo-, methyl ester
5-Brom-2-jod-benzoesaeure-methylester
5-bromo-2-iodo-benzoic acid methyl ester
methyl 2-iodo-5-bromobenzoate
5-Bromo-2-iodobenzoic Acid Methyl Ester
BENZOIC ACID 5-BROMO-2-IODO-METHYL ESTER
KSC537S7F
WT311
EBD17959
CM12520
LS10771

MDL Number

MFCD00144771

Customs Code

2916399090

FAQ

What is Methyl 5-bromo-2-iodobenzoate (CAS: 181765-86-6)?

Methyl 5-bromo-2-iodobenzoate (CAS: 181765-86-6) is a chemical compound with a molecular formula of C8H7BrI05. It is a solid at room temperature and is used in research and pharmaceutical applications due to its unique chemical properties.

What are the main uses of Methyl 5-bromo-2-iodobenzoate (CAS: 181765-86-6)?

Methyl 5-bromo-2-iodobenzoate (CAS: 181765-86-6) is primarily used in the synthesis of various pharmaceuticals and intermediates, as well as in research for studying organic reactions and as a reagent in chemical synthesis.

Is Methyl 5-bromo-2-iodobenzoate (CAS: 181765-86-6) safe?

Methyl 5-bromo-2-iodobenzoate (CAS: 181765-86-6) is not considered inherently hazardous, but it should be handled with care due to its reactivity. Proper protective measures, including gloves and goggles, should be worn to avoid skin and eye contact.

How should Methyl 5-bromo-2-iodobenzoate (CAS: 181765-86-6) be stored?

Methyl 5-bromo-2-iodobenzoate (CAS: 181765-86-6) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture and light exposure. Avoid storing it near incompatible materials such as reducing agents or strong oxidizing agents.