3-Ethyl-3-(3-hydroxyphenyl)-1-methyl-2-azepanone

Basic Information

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CAS Number

71556-74-6

Molecular Formula

C15H21NO2

Molecular Weight

247.34 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

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

172-180 ºC

Boiling Point

429.8°C at 760 mmHg

Density

1.073

Flash Point

213.7°C

Refractive Index

1.534

SMILES

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CCC1(CCCCN(C1=O)C)C2=CC(=CC=C2)O

InChI

InChI=1S/C15H21NO2/c1-3-15(12-7-6-8-13(17)11-12)9-4-5-10-16(2)14(15)18/h6-8,11,17H,3-5,9-10H2,1-2H3

InChIKey

YFSJZMANJNLCOQ-UHFFFAOYSA-N

LogP

2.6823000000000006

Topological Polar Surface Area

40.540000000000006 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

305

Synonyms & References

English

CS-0326555
2H-Azepin-2-one,3-ethylhexahydro-3-(3-hydroxyphenyl)-1-methyl-
3-ethyl-3-(3-hydroxy-phenyl) -1-methyl-azepan-2-one
3-Ethyl-hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one
Hexahydro-3-ethyl-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one
NS00061677
AC-24410
3-Ethyl-3-(hydroxyphenyl)-1-methylazepan-2-one
EINECS 275-622-0
3-ethyl-3-(3-hydroxy-phenyl)-1-methyl-azepan-2-one
3-Ethylhexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one
SCHEMBL7190137
J-512423
71556-74-6
3-ethyl-3-(3-hydroxyphenyl)-1-methylazepan-2-one
DTXSID00992113
AKOS015994607
HS-0019
FT-0705989
MFCD00276840
YFSJZMANJNLCOQ-UHFFFAOYSA-N
3-Ethyl-3-(3-hydroxyphenyl)-1-methylazepan-2-one
3-Ethyl-3-(3-hydroxyphenyl)-1-methylazepan-2-one, tech
3-ethylhexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one
3-ethylhexahydro-3-(3-hydroxyphenyl)-1-methylazepin-2-one
ethyl-3-(3-hydroxyphenyl)-1-methylazepan-2-one

MDL Number

MFCD00276840

Customs Code

2933790090

FAQ

What is 3-Ethyl-3-(3-hydroxyphenyl)-1-methyl-2-azepanone (CAS: 71556-74-6)?

3-Ethyl-3-(3-hydroxyphenyl)-1-methyl-2-azepanone (CAS: 71556-74-6) is a complex organic compound with a unique molecular structure. It is a cyclic azepane derivative with a benzene ring substituent and alkyl side chains.

What are the main uses of 3-Ethyl-3-(3-hydroxyphenyl)-1-methyl-2-azepanone (CAS: 71556-74-6)?

3-Ethyl-3-(3-hydroxyphenyl)-1-methyl-2-azepanone (CAS: 71556-74-6) is primarily used in pharmaceutical research for developing new drug candidates. It also has applications in the synthesis of other organic compounds and as a building block in chemical libraries.

Is 3-Ethyl-3-(3-hydroxyphenyl)-1-methyl-2-azepanone (CAS: 71556-74-6) safe?

3-Ethyl-3-(3-hydroxyphenyl)-1-methyl-2-azepanone (CAS: 71556-74-6) is generally considered safe for laboratory use when appropriate safety measures are followed. However, it may cause skin irritation if not handled properly, and it should be stored in a well-ventilated area and away from ignition sources.

How should 3-Ethyl-3-(3-hydroxyphenyl)-1-methyl-2-azepanone (CAS: 71556-74-6) be stored?

3-Ethyl-3-(3-hydroxyphenyl)-1-methyl-2-azepanone (CAS: 71556-74-6) 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 degradation and exposure to air and moisture. This compound may not be stable at high temperatures, so it is important to maintain a temperature below 30°C (86°F) to ensure its integrity.