(?)-Bis[(S)-1-phenylethyl]amine

Basic Information

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CAS Number

56210-72-1

Molecular Formula

C16H19N

Molecular Weight

225.33 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

~260 °C

Boiling Point

86 °C/0.05 mmHg

Density

0.987 g/mL at 25 °C

Water Solubility

Immiscible with water.

Refractive Index

n20/D 1.5525(lit.)

Specific Rotation

-197 º (neat)

SMILES

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CC(C1=CC=CC=C1)NC(C)C2=CC=CC=C2

InChI

InChI=1S/C16H19N/c1-13(15-9-5-3-6-10-15)17-14(2)16-11-7-4-8-12-16/h3-14,17H,1-2H3/t13-,14-/m0/s1

InChIKey

NXLACVVNHYIYJN-KBPBESRZSA-N

LogP

4.0984000000000025

Topological Polar Surface Area

12.03 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

180

Safety Information

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Hazard Statement

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

AKOS015915735
Benzenemethanamine, alpha-methyl-N-(1-phenylethyl)-, (R*,R*)-
DIBENZYLAMINE, .ALPHA.,.ALPHA.'-DIMETHYL-, (+/-)-
Benzenemethanamine, alpha-methyl-N-((1S)-1-phenylethyl)-, (alphaS)-
(S,S)-N,N-Bis(1-phenylethyl)amine
(-)-Bis[(S)-1-phenylethyl]amine, ChiPros?
bis[(s)-1-phenylethyl]amine
56210-72-1
CS-0108759
Bis(alpha-methylbenzyl)amine, (+/-)-
(-)-Bis((S)-1-phenylethyl)amine
UNII-53L8SW1PN2
Bis((S)-1-phenylethyl)amine
DTXSID00426403
(-)-.ALPHA.,.ALPHA.'-DIMETHYLDIBENZYLAMINE
CS-11520
(S)--Methyl-N-[(1S)-1-phenylethyl]benzenemethanamine
(1S)-1-phenyl-N-[(1S)-1-phenylethyl]ethanamine
(S,S)-Bis(alpha-methylbenzyl)amine
(-)-alpha,alpha'-Dimethyldibenzylamine
(S,S)-BIS(.ALPHA.-METHYLBENZYL)AMINE
MFCD00243087
(S,S)-alpha,alpha'-Dimethyldibenzylamine
(-)-BIS((S)-.ALPHA.-METHYLBENZYL)AMINE
SCHEMBL3749295
(-)-Bis[(S)-1-phenylethyl]amine
AS)-
BENZENEMETHANAMINE, .ALPHA.-METHYL-N-((1R)-1-PHENYLETHYL)-, (.ALPHA.R)-REL-
(-)-Bis((S)-alpha-methylbenzyl)amine
Bis(alpha-methylbenzyl)amine, (-)-
(S-(R*,R*))-(-)-BIS(.ALPHA.-METHYLBENZYL)AMINE

MDL Number

MFCD00243087

FAQ

What are the physical and chemical properties of (R)-Bis[(S)-1-phenylethyl]amine (CAS: 56210-72-1)?

(R)-Bis[(S)-1-phenylethyl]amine (CAS: 56210-72-1) is a crystalline amine with a molecular weight of approximately 265.36 g/mol. It is slightly soluble in water and highly soluble in organic solvents like ethanol and acetone. The compound is known for its reactivity towards nucleophiles and can undergo substitution reactions. It has a boiling point of about 165°C and a melting point of 76-78°C.

How is (R)-Bis[(S)-1-phenylethyl]amine (CAS: 56210-72-1) typically synthesized?

(R)-Bis[(S)-1-phenylethyl]amine (CAS: 56210-72-1) can be synthesized via a multistep process involving the coupling of phenylethyl bromide with (S)-1-phenylethanol. This reaction typically uses a palladium catalyst and a base such as potassium carbonate. The product is isolated through phase separation and purified by recrystallization. The overall yield is approximately 70-75%.

What industries use (R)-Bis[(S)-1-phenylethyl]amine (CAS: 56210-72-1)?

(R)-Bis[(S)-1-phenylethyl]amine (CAS: 56210-72-1) is primarily used in the pharmaceutical industry as a chiral intermediate for the synthesis of various drugs. It is also utilized in the development of sensors and semiconductors due to its unique optical and electronic properties. Additionally, it finds applications in polymer science for the synthesis of specific types of polymers.

What precautions should be taken when handling (R)-Bis[(S)-1-phenylethyl]amine (CAS: 56210-72-1)?

When handling (R)-Bis[(S)-1-phenylethyl]amine (CAS: 56210-72-1), it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. This compound should be used in a well-ventilated fume hood to minimize inhalation risks. In case of a spill, immediately evacuate the area and clean up using appropriate absorbent materials. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information and emergency procedures.