(1S)-1-(3-Nitrophenyl)ethanamine

Basic Information

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CAS Number

297730-25-7

Molecular Formula

C8H10N2O2

Molecular Weight

166.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

SMILES

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CC(C1=CC(=CC=C1)[N+](=O)[O-])N

InChI

InChI=1S/C8H10N2O2/c1-6(9)7-3-2-4-8(5-7)10(11)12/h2-6H,9H2,1H3/t6-/m0/s1

InChIKey

AVIBPONLEKDCPQ-LURJTMIESA-N

LogP

2.83800

Complexity

167

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

(1S)-1-(3-nitrophenyl)ethanamine
297730-25-7
(S)-1-(3-nitrophenyl)ethanamine hydrochloride;(S)-1-(3-Nitrophenyl)ethanamine
(s)-1-(3-nitrophenyl)ethanamine
EN300-1829350
(1S)-1-(3-nitrophenyl)ethan-1-amine
XLA73025
CS-0000320
(S)-3-nitrophenethylamine hcl
Benzenemethanamine, a-methyl-3-nitro-, (aS)-
Benzenemethanamine, -methyl-3-nitro-, (S)-
SCHEMBL3474257
AKOS017358053
(S)-1-(3-NITROPHENYL)-1-AMINOETHANE
(S)-1-(3-Nitrophenyl)ethylamine
AVIBPONLEKDCPQ-LURJTMIESA-N
MFCD06659477
(S)-1-(3-nitrophenyl)ethan-1-amine
DS-12134
(S)-1-(3-NITROPHENYL)ETHYLAMINE
(S)-3-Nitrophenethylamine HCl
(S)-1-(3-Nitrophenyl)-1-aminoethane

MDL Number

MFCD06659477

FAQ

What are the physical and chemical properties of (1S)-1-(3-Nitrophenyl)ethanamine (CAS: 297730-25-7)?

(1S)-1-(3-Nitrophenyl)ethanamine is a crystalline solid with a molecular weight of approximately 185.11 g/mol. It has a pKa of around 8.5 and is poorly soluble in water but more soluble in organic solvents like ethanol and acetone. The compound is moderately reactive, especially under basic conditions, and can undergo substitution reactions. It sublimes readily and has a distinct odor.

How is (1S)-1-(3-Nitrophenyl)ethanamine (CAS: 297730-25-7) typically synthesized?

(1S)-1-(3-Nitrophenyl)ethanamine can be synthesized by the reaction of 3-nitrophenol with ethylamine in the presence of a base like sodium hydroxide. The reaction proceeds via an alkyl substitution mechanism, yielding a high yield of the desired product. The process is typically conducted under mild conditions to ensure selectivity and yield.

What industries use (1S)-1-(3-Nitrophenyl)ethanamine (CAS: 297730-25-7)?

(1S)-1-(3-Nitrophenyl)ethanamine finds applications in various industries, particularly in the pharmaceutical sector where it serves as a precursor for the synthesis of certain azo dyes and as a building block for drug development. It is also used in the production of organic semiconductors and in the development of chemical sensors.

What precautions should be taken when handling (1S)-1-(3-Nitrophenyl)ethanamine (CAS: 297730-25-7)?

When handling (1S)-1-(3-Nitrophenyl)ethanamine, it is important to use appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood to minimize inhalation risk. Spills should be cleaned up immediately using appropriate absorbent materials. Always consult the Material Safety Data Sheet (MSDS/SDS) for detailed safety information and follow all laboratory safety guidelines.