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6-[6-[(2-tert-butyl-7-chloro-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(6-chloro-2,3-dihydro-1-benzofuran-5-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(5-chloro-2-ethyl-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(4-chloro-2-methyl-1,3-benzothiazol-5-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(5-chloro-2-propan-2-yl-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[[7-chloro-2-(trifluoromethyl)-1,3-benzothiazol-6-yl]oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(2,2-dimethyl-3H-1-benzofuran-5-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;4-methyl-6-[6-[(2-methyl-1,3-benzothiazol-5-yl)oxy]pyridin-3-yl]hex-5-en-2-one;4-methyl-6-[6-[[2-(trifluoromethyl)-1,3-benzothiazol-6-yl]oxy]pyridin-3-yl]hex-5-en-2-one

6-[6-[(2-tert-butyl-7-chloro-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(6-chloro-2,3-dihydro-1-benzofuran-5-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(5-chloro-2-ethyl-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(4-chloro-2-methyl-1,3-benzothiazol-5-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(5-chloro-2-propan-2-yl-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[[7-chloro-2-(trifluoromethyl)-1,3-benzothiazol-6-yl]oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(2,2-dimethyl-3H-1-benzofuran-5-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;4-methyl-6-[6-[(2-methyl-1,3-benzothiazol-5-yl)oxy]pyridin-3-yl]hex-5-en-2-one;4-methyl-6-[6-[[2-(trifluoromethyl)-1,3-benzothiazol-6-yl]oxy]pyridin-3-yl]hex-5-en-2-one | CAS No. 54182-57-9

6-[6-[(2-tert-butyl-7-chloro-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(6-chloro-2,3-dihydro-1-benzofuran-5-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(5-chloro-2-ethyl-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(4-chloro-2-methyl-1,3-benzothiazol-5-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(5-chloro-2-propan-2-yl-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[[7-chloro-2-(trifluoromethyl)-1,3-benzothiazol-6-yl]oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;6-[6-[(2,2-dimethyl-3H-1-benzofuran-5-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one;4-methyl-6-[6-[(2-methyl-1,3-benzothiazol-5-yl)oxy]pyridin-3-yl]hex-5-en-2-one;4-methyl-6-[6-[[2-(trifluoromethyl)-1,3-benzothiazol-6-yl]oxy]pyridin-3-yl]hex-5-en-2-one

Basic Information

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CAS Number

54182-57-9

Molecular Formula

C188H186Cl6F6N16O20S7

Molecular Weight

72.06 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

12.5 deg C

Boiling Point

141 deg C

SMILES

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CCC1=NC2=CC(=C(C=C2S1)OC3=NC=C(C=C3)C=CC(C)CC(=O)C)Cl.CC1=NC2=C(S1)C=CC(=C2)OC3=NC=C(C=C3)C=CC(C)CC(=O)C.CC1=NC2=C(S1)C=CC(=C2Cl)OC3=NC=C(C=C3)C=CC(C)CC(=O)C.CC(C)C1=NC2=CC(=C(C=C2S1)OC3=NC=C(C=C3)C=CC(C)CC(=O)C)Cl.CC(CC(=O)C)C=CC1=CN=C(C=C1)OC2=CC3=C(C=C2)OC(C3)(C)C.CC(CC(=O)C)C=CC1=CN=C(C=C1)OC2=CC3=C(C=C2)N=C(S3)C(F)(F)F.CC(CC(=O)C)C=CC1=CN=C(C=C1)OC2=C(C3=C(C=C2)N=C(S3)C(C)(C)C)Cl.CC(CC(=O)C)C=CC1=CN=C(C=C1)OC2=C(C3=C(C=C2)N=C(S3)C(F)(F)F)Cl.CC(CC(=O)C)C=CC1=CN=C(C=C1)OC2=C(C=C3C(=C2)CCO3)Cl

InChI

InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)

InChIKey

NIXOWILDQLNWCW-UHFFFAOYSA-N

LogP

0.25700000000000006

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

4870

Synonyms & References

English

54182-57-9
84961-57-9
Carbomer
CARBOMER 934
TR-2
：Carbomer
carbomer 980
Carbomer HomopolymerB

FAQ

What is 6-[6-[(2-tert-butyl-7-chloro-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one (CAS: 54182-57-9)?

6-[6-[(2-tert-butyl-7-chloro-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one (CAS: 54182-57-9) is an organic compound characterized by a complex structure containing a benzothiazole ring and a pyridine ring linked through an oxygen bridge. It is a yellow solid with a molecular formula of C23H26ClNO3S and exhibits moderate solubility in organic solvents. This compound is often used in chemical research for its reactivity and structural versatility.

What are the main uses of 6-[6-[(2-tert-butyl-7-chloro-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one (CAS: 54182-57-9)?

This compound is primarily used in pharmaceutical research as a key intermediate in the synthesis of various drugs and medicinal compounds. It also finds applications in organic chemistry for developing new materials and in the study of chemical reactivity. Due to its structural features, it is utilized in research related to bioactive molecules and functional group modifications.

Is 6-[6-[(2-tert-butyl-7-chloro-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one (CAS: 54182-57-9) safe?

The safety of 6-[6-[(2-tert-butyl-7-chloro-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one (CAS: 54182-57-9) depends on its handling and application. As a chemical intermediate, it may require proper personal protective equipment (PPE) such as gloves and goggles. It is advisable to follow standard safety protocols and consult safety data sheets (SDS) for detailed information on toxicity and exposure limits.

How should 6-[6-[(2-tert-butyl-7-chloro-1,3-benzothiazol-6-yl)oxy]pyridin-3-yl]-4-methylhex-5-en-2-one (CAS: 54182-57-9) be stored?

This compound should be stored in a cool, dry, and dark place, ideally at 2-8°C. It is recommended to keep it in a sealed container to prevent moisture and air exposure. Proper storage conditions help maintain its chemical stability and prevent degradation. Avoid prolonged exposure to light and ensure it is kept away from incompatible substances.