4-Benzyl-2-(chloromethyl)morpholine

Basic Information

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CAS Number

40987-25-5

Molecular Formula

C12H16ClNO

Molecular Weight

225.72 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

OFF-WHITE POWDER

Melting Point

46-50 ºC

Boiling Point

314.6℃ at 760 mmHg

Flash Point

144.1℃

SMILES

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C1COC(CN1CC2=CC=CC=C2)CCl

InChI

InChI=1S/C12H16ClNO/c13-8-12-10-14(6-7-15-12)9-11-4-2-1-3-5-11/h1-5,12H,6-10H2

InChIKey

GVWRZZNYCOTWNN-UHFFFAOYSA-N

LogP

2.1262

Topological Polar Surface Area

12.47 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

183

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 IRRITANT Class IRRITANT

Synonyms & References

English

4-benzyl-2-chloromethylmorpholine
4-Benzyl-2-(chloromethyl)morpholine, AldrichCPR
3-(Chloromethyl)-4-(phenylmethyl)morpholine
Morpholine, 2-(chloromethyl)-4-(phenylmethyl)-
Z57046220
2-Chloromethyl-4-benzylmorpholine
2-chloromethyl-4-benzyl-morpholine
4-benzyl-2-(chloromethyl) morpholine
EN300-07729
SCHEMBL735729
GVWRZZNYCOTWNN-UHFFFAOYSA-N
CS-0037413
4-benzyl-2-chloromethyl morpholine
AMY11027
SB46311
MFCD02681886
4-benzyl-2-(chloromethyl)morpholine
A6822
AB12150
CS-11249
AKOS016051284
40987-25-5
2-chloromethyl-4-benzyl morpholine
SB46567
AKOS000122911
AC-26722
4-Benzyl-2-chloromethyl-morpholine
FT-0617643
SY012327
2-chloromethyl-4-(phenylmethyl)morpholine
4-Benzyl-2-(chloromethyl)morpholine

MDL Number

MFCD02681886

Customs Code

2934999090

FAQ

What are the physical and chemical properties of 4-Benzyl-2-(chloromethyl)morpholine (CAS: 40987-25-5)?

4-Benzyl-2-(chloromethyl)morpholine is a colorless to pale yellow liquid with a molecular weight of approximately 221.64 g/mol. It has a high boiling point and is moderately soluble in water. The compound is mildly reactive, particularly with bases and nucleophiles. It is used in synthesis due to its functional groups, which facilitate various chemical reactions.

How is 4-Benzyl-2-(chloromethyl)morpholine (CAS: 40987-25-5) typically synthesized?

4-Benzyl-2-(chloromethyl)morpholine can be synthesized by reacting benzyl bromide with morpholine in the presence of a base such as potassium carbonate. The reaction proceeds via a nucleophilic substitution, yielding the desired product with good yield and selectivity. Common solvents include dichloromethane or dimethylformamide.

What industries use 4-Benzyl-2-(chloromethyl)morpholine (CAS: 40987-25-5)?

4-Benzyl-2-(chloromethyl)morpholine is primarily used in the pharmaceutical industry for drug synthesis due to its functional groups. It is also utilized in polymer chemistry for the creation of advanced materials and in the development of sensors and other chemical applications requiring specific reactivity and functionality.

What precautions should be taken when handling 4-Benzyl-2-(chloromethyl)morpholine (CAS: 40987-25-5)?

When handling 4-Benzyl-2-(chloromethyl)morpholine, it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be cleaned up using appropriate chemicals, and the substance should be stored in a cool, dry place away from direct sunlight. Always refer to the safety data sheet (SDS) for detailed safety information.