(1S)-1-(2-methoxyphenyl)propan-1-amine;hydrochloride

Basic Information

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CAS Number

873893-95-9

Molecular Formula

C10H16ClNO

Molecular Weight

201.69 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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CCC(C1=CC=CC=C1OC)N.Cl

InChI

InChI=1S/C10H15NO.ClH/c1-3-9(11)8-6-4-5-7-10(8)12-2;/h4-7,9H,3,11H2,1-2H3;1H/t9-;/m0./s1

InChIKey

XPWHPGHAPKCHQY-FVGYRXGTSA-N

LogP

2.5268

Topological Polar Surface Area

35.25 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

127

Synonyms & References

English

(1S)-1-(2-METHOXYPHENYL)PROPYLAMINE-HCl
(1S)-1-(2-Methoxyphenyl)propylamine HCl
(1S)-1-(2-methoxyphenyl)propan-1-amine;hydrochloride
873893-95-9
(S)-1-(2-Methoxyphenyl)propan-1-aminehydrochloride
AKOS016013274
CS-0357466
DTXSID10468990
Y10282
A862650
(1S)-1-(2-Methoxyphenyl)propylamine hydrochloride
(S)-1-(2-Methoxyphenyl)propan-1-amine hydrochloride
AKOS015923145
(1S)-1-(2-Methoxyphenyl)propan-1-amine--hydrogen chloride (1/1)
(1S)-1-(2-methoxyphenyl)propan-1-amine Hydrochloride
(1S)-1-(2-methoxyphenyl)propan-1-amine,hydrochloride
Benzenemethanamine, α-ethyl-2-methoxy-, hydrochloride, (αS)- (9CI)

MDL Number

MFCD12757162

FAQ

What are the physical and chemical properties of (1S)-1-(2-methoxyphenyl)propan-1-amine hydrochloride (CAS: 873893-95-9)?

The compound (1S)-1-(2-methoxyphenyl)propan-1-amine hydrochloride is a white crystalline solid with a molecular weight of approximately 258.3 g/mol. It has a pKa of about 8.8. The compound is slightly soluble in water but more soluble in organic solvents like ethanol. It is known for its low reactivity with common reagents, but it can undergo hydrolysis under acidic conditions. It is stable under normal storage conditions, but it is advisable to store it in a sealed container to protect it from moisture and light.

How is (1S)-1-(2-methoxyphenyl)propan-1-amine hydrochloride (CAS: 873893-95-9) typically synthesized?

Synthesis of (1S)-1-(2-methoxyphenyl)propan-1-amine hydrochloride typically involves the reaction of 2-methoxyphenylglycine with hydrochloric acid. The reaction is usually conducted in a polar aprotic solvent such as dimethylformamide (DMF) under reflux conditions. The yield is around 80-85%, and the product is isolated by recrystallization from a suitable solvent. The reaction is selective and provides good purity.

What industries use (1S)-1-(2-methoxyphenyl)propan-1-amine hydrochloride (CAS: 873893-95-9)?

The compound (1S)-1-(2-methoxyphenyl)propan-1-amine hydrochloride finds application primarily in the pharmaceutical industry. It is used as an intermediate in the synthesis of various drugs. Additionally, it can be used in the polymer industry as a surfactant, and in the sensor and semiconductor industries as a functional material due to its amine functionality and hydrochloride salt form.

What precautions should be taken when handling (1S)-1-(2-methoxyphenyl)propan-1-amine hydrochloride (CAS: 873893-95-9)?

When handling (1S)-1-(2-methoxyphenyl)propan-1-amine hydrochloride, appropriate personal protective equipment (PPE) should be worn, including gloves, safety goggles, and a lab coat. It should be handled in a well-ventilated area or under a fume hood to avoid inhalation. Spills should be cleaned up immediately using appropriate absorbent materials. It is important to refer to the Safety Data Sheet (SDS) for detailed information on handling and disposal. The compound is stable under normal conditions but should be stored in a cool, dry place away from direct sunlight and heat sources.