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Merck
CN

77870

(S)-(−)-α-Methylbenzylamine

purum, ≥98.0% (sum of enantiomers, GC)

Synonym(s):

(S)-(-)-alpha-Methylbenzylamine, (S)-(−)-1-Phenylethylamine

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About This Item

Linear Formula:
C6H5CH(CH3)NH2
CAS Number:
2627-86-3
Molecular Weight:
121.18
EC Number:
220-098-0
UNSPSC Code:
12352116
PubChem Substance ID:
329767987
Beilstein/REAXYS Number:
2204907
MDL number:
MFCD00064406

Key Documents

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vapor pressure

0.5 mmHg ( 20 °C)

grade

purum

assay

≥98.0% (sum of enantiomers, GC)

optical activity

[α]20/D −30±2°, c = 10% in ethanol

optical purity

enantiomeric ratio: ≥97:3 (GC)

refractive index

n20/D 1.526 (lit.), n20/D 1.528

bp

187 °C (lit.)

density

0.94 g/mL at 25 °C (lit.)

SMILES string

C[C@H](N)c1ccccc1

InChI

1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/t7-/m0/s1

InChI key

RQEUFEKYXDPUSK-ZETCQYMHSA-N

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pictograms

Skull and crossbonesCorrosion
GHS06,GHS05

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 4 Oral - Skin Corr. 1B

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk

WGK 1

flash_point_f

158.0 °F - closed cup

flash_point_c

70 °C - closed cup

ppe

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

Regulatory Information

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Timo Z Nazari-Shafti et al.
Biomolecules, 10(9) (2020-09-26)
The cardioprotective properties of extracellular vesicles (EVs) derived from mesenchymal stromal cells (MSCs) are currently being investigated in preclinical studies. Although microRNAs (miRNAs) encapsulated in EVs have been identified as one component responsible for the cardioprotective effect of MSCs, their
Shao-Hua Huang et al.
Magnetic resonance in chemistry : MRC, 47(5), 423-427 (2009-02-19)
Two types of chiral analytes, the urea and amide derivatives of alpha-phenylethylamine, were prepared. The effect of inter-molecular hydrogen-bonding interaction on self-discrimination of the enantiomers of analytes has been investigated using high-resolution (1)H NMR. It was found that the urea
Manuel Algarra et al.
Journal of separation science, 33(2), 143-154 (2009-12-31)
Free fatty acids were derivatized as amides (DFFA) by reaction with (R)-(+)-1-phenylethylamine, using a simple, fast and robust reaction scheme. A HPLC method with diode array and ESI MS detection was developed for the analysis of the derivatized substances. Six
Karim Engelmark Cassimjee et al.
Organic & biomolecular chemistry, 10(28), 5466-5470 (2012-06-13)
For biocatalytic production of pharmaceutically important chiral amines the ω-transaminase enzymes have proven useful. Engineering of these enzymes has to some extent been accomplished by rational design, but mostly by directed evolution. By use of a homology model a key
Andrew T Fischer et al.
The journal of physical chemistry. B, 111(28), 8187-8196 (2007-06-23)
Speed-of-sound measurements are reported for RS (racemic) and S liquid alpha-methylbenzylamine (MBA) obtained using a modified design of previously published experimental geometry. After correcting for density changes, the resulting isentropic compressibility of the S liquid is found to be 2%
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Global Trade Item Number

SKUGTIN
R7385-.5MG04061833274040
R7385-10MG04061833274057
R7385-1MG04061826676806
R7385-25MG04061833274064
R7385-5MG04061833274071

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