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549142

Sigma-Aldrich

1-(4-Chlorophenyl)ethylamine

97%

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About This Item

Linear Formula:
ClC6H4CH(NH2)CH3
CAS Number:
6299-02-1
Molecular Weight:
155.62
EC Number:
228-576-0
MDL number:
MFCD00044766
UNSPSC Code:
12352100
PubChem Substance ID:
24879062
NACRES:
NA.22

assay

97%

refractive index

n20/D 1.543 (lit.)

density

1.080 g/mL at 25 °C (lit.)

SMILES string

CC(N)c1ccc(Cl)cc1

InChI

1S/C8H10ClN/c1-6(10)7-2-4-8(9)5-3-7/h2-6H,10H2,1H3

InChI key

PINPOEWMCLFRRB-UHFFFAOYSA-N

Application

1-(4-Chlorophenyl)ethylamine is a chiral amine that may be used in the preparation of N-phenylacetyl-(R)-1-(4-chlorophenyl)ethylamine via enantioselective acylation in aqueous medium and in the presence of penicillin acylase from Alcaligenes faecalis.

pictograms

Corrosion
GHS05

signalword

Danger

hcodes

H314

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

wgk_germany

WGK 3

flash_point_f

217.0 °F - closed cup

flash_point_c

102.8 °C - closed cup

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

Certificates of Analysis (COA)

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Highly efficient and enantioselective enzymatic acylation of amines in aqueous medium.
Guranda DT, et al.
Tetrahedron Asymmetry, 12(11), 1645-1650 (2001)

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