2-[(Dimethylamino)methyl]cyclohexanone hydrochloride (1:1)

Basic Information

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CAS Number

42036-65-7

Molecular Formula

C9H18ClNO

Molecular Weight

191.7 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Physical Properties

Melting Point

147-151 ºC

SMILES

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CN(C)CC1CCCCC1=O.Cl

InChI

InChI=1S/C9H17NO.ClH/c1-10(2)7-8-5-3-4-6-9(8)11;/h8H,3-7H2,1-2H3;1H

InChIKey

CLVHTSWMNNSUSH-UHFFFAOYSA-N

LogP

1.7291

Topological Polar Surface Area

20.310000000000002 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

143

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

2-((Dimethylamino)methyl)cyclohexanone hydrochloride, (2RS)-
2-[(dimethylamino)methyl]cyclohexan-1-one;hydrochloride
NSC620461
Q27273254
2-[(Dimethylamino)methyl]cyclohexanonehydrochloride
EC 700-355-8
CS-W010717
SCHEMBL3120247
CCG-54700
2-Dimethylaminomethyl-cyclohexanone
NSC-620461
MLS001029693
AKOS016008719
42036-65-7
CHEMBL1329354
SR-01000390594-2
Dimethyl((2-oxocyclohexyl)methyl)ammonium chloride
DS-5013
2-[(DIMETHYLAMINO)METHYL]CYCLOHEXANONE HYDROCHLORIDE
(2RS)-2-[(Dimethylamino)methyl]cyclohexanone Hydrochloride
Cyclohexanone, 2-((dimethylamino)methyl)-, hydrochloride (1:1)
UNII-9UU6LE6AUC
2-Dimethylaminomethyl-cyclohexanone hydrochloride
2-(Bismethyl)aminomethylcyclohexanone Hydrochloride
NSC12467
2-dimethylaminomethylcyclohexanone hydrochloride
2-((Dimethylamino)methyl)cyclohexanone hydrochloride
9UU6LE6AUC
MFCD00102580
2-((Dimethylamino)methyl)cyclohexanonehydrochloride
2-(Dimethylaminomethyl)-1-cyclohexanone hydrochloride

MDL Number

MFCD00102580

FAQ

What is 2-[(Dimethylamino)methyl]cyclohexanone hydrochloride (CAS: 42036-65-7)?

2-[(Dimethylamino)methyl]cyclohexanone hydrochloride (CAS: 42036-65-7) is a colorless or slightly yellowish crystalline compound. It is used in pharmaceuticals, research, and as a precursor in organic synthesis. The chemical formula is C11H20NO•HCl. It has a characteristic odor and is soluble in water and ethanol.

What are the main uses of 2-[(Dimethylamino)methyl]cyclohexanone hydrochloride (CAS: 42036-65-7)?

2-[(Dimethylamino)methyl]cyclohexanone hydrochloride (CAS: 42036-65-7) is primarily used as an intermediate in the synthesis of pharmaceuticals, particularly in the development of new drugs. It is also used in research for studying organic chemistry and as a reagent in various chemical processes.

Is 2-[(Dimethylamino)methyl]cyclohexanone hydrochloride (CAS: 42036-65-7) safe?

2-[(Dimethylamino)methyl]cyclohexanone hydrochloride (CAS: 42036-65-7) is generally safe for use when handled properly. However, it should be used with caution due to its potential for skin and respiratory irritation. Proper protective equipment, such as gloves and a respirator, is recommended.

How should 2-[(Dimethylamino)methyl]cyclohexanone hydrochloride (CAS: 42036-65-7) be stored?

2-[(Dimethylamino)methyl]cyclohexanone hydrochloride (CAS: 42036-65-7) should be stored in a cool, dry place, protected from light. It should be kept in a tightly sealed container to prevent moisture absorption. The storage temperature should not exceed 25°C (77°F).