(S)-Cyano(3-phenoxyphenyl)methyl (1R,3R)-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate

Basic Information

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CAS Number

52918-63-5

Molecular Formula

C22H19Br2NO3

Molecular Weight

505.2 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

Basic Chemical Raw Materials Organic Chemicals Nitriles

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

99.0 to 103.0 deg-C

Boiling Point

300 ºC

Density

1.5214 (rough estimate)

Refractive Index

1.6220 (estimate)

SMILES

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CC1([C@H]([C@H]1C(=O)O[C@H](C#N)c2cccc(c2)Oc3ccccc3)C=C(Br)Br)C

InChI

InChI=1S/C22H19Br2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17-,18+,20-/m0/s1

InChIKey

OWZREIFADZCYQD-NSHGMRRFSA-N

Complexity

643

Safety Information

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Hazard Statement

H312 Harmful in contact with skin
Acute toxicity, dermal

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H410 Very toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Hazard Class

Class 6.1 Class 6.1

Stability

Stable. Incompatible with acids, alkalies, strong oxidizing agents.

Toxicity

LD50 in female rats (mg/kg): 31 orally; 4 i.v. (Kavlock)

Synonyms & References

English

Decamethrin
Deltamethrin
(S)-α-Cyano-m-phenoxybenzyl-(1R,3R)-3-(2,2-dibromoyinyl)-2-dimethyl cyclopropane carboxylate
(S)α-cyano-3-phenoxybenzyl(1R)-cis-3-(2,2-dibromovinyl) -2,2-methylcyclopropanecarboxylate
Delatmethrin
Cyano(3-phenoxyphenyl)methyl 3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate
Deltamethrin Solution
(S)-Cyano(4-phenoxyphenyl)methyl 3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate, (1R,3R)-
Cislin
Crackdown
Cyclopropanecarboxylic acid, 3-(2,2-dibromoethenyl)-2,2-dimethyl-, (S)
Cyclopropanecarboxylic acid, 3-(2,2-dibromoethenyl)-2,2-dimethyl-, cyano(3-phenoxyphenyl)methyl ester, (1R-(1α(S*),3α))-
Decamethrine
Decis
Dekametrin
Deltamethrin100µg
Deltamethrine
Esbecythrin
FMC 45498
K-Obiol
K-Othrin
NRDC 161
OMS 1988
RU 22974
(S)-α-Cyano-3-phenoxybenzyl (1R,3R)-3-(2,2-Dibromovinyl)-2,2-dimethylcyclopropanecarboxylate
(1R,3R)-3-(2,2-Dibromovinyl)-2,2-dimethylcyclopropanecarboxylic Acid (S)-α-Cyano-3-phenoxybenzyl Ester
(S)-alpha-Cyano-3-phenoxybenzyl (1R,3R)-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate
(S)-cyano(3-phenoxyphenyl)methyl (1R,3R)-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropane-1-carboxylate

MDL Number

MFCD00870122

Customs Code

29269090

FAQ

What is (S)-Cyano(3-phenoxyphenyl)methyl (1R,3R)-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate (CAS: 52918-63-5)?

This compound is a synthetic organic molecule with the CAS number 52918-63-5. It contains a cyano group attached to a 3-phenoxyphenylmethyl chain and is part of a cyclopropanecarboxylate structure with stereochemistry specified as (1R,3R). The compound is known for its complex chemical structure and is often used in specialized chemical research and pharmaceutical development.

What are the main uses of (S)-Cyano(3-phenoxyphenyl)methyl (1R,3R)-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate (CAS: 52918-63-5)?

This compound is primarily used in pharmaceutical research for the development of novel drug candidates, particularly in the study of enzyme inhibition and receptor interactions. It also finds applications in organic synthesis as a key intermediate and in the formulation of specialized chemical products requiring precise structural control.

Is (S)-Cyano(3-phenoxyphenyl)methyl (1R,3R)-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate (CAS: 52918-63-5) safe?

Safety considerations for this compound include its potential toxicity and reactivity. It should be handled with appropriate personal protective equipment (PPE) and in a well-ventilated area. While specific safety standards may vary, it is generally recommended to follow standard chemical safety protocols to minimize exposure risks.

How should (S)-Cyano(3-phenoxyphenyl)methyl (1R,3R)-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate (CAS: 52918-63-5) be stored?

This compound should be stored in a cool, dry, and dark place to maintain stability. It is best kept in a sealed container away from moisture and light exposure. Storage conditions should be controlled to prevent degradation, typically at temperatures below 25°C and in a humidity-controlled environment.