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Merck
CN

560472

2-(4-Morpholino)ethyl isothiocyanate

96%

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About This Item

Empirical Formula (Hill Notation):
C7H12N2OS
CAS Number:
63224-35-1
Molecular Weight:
172.25
NACRES:
NA.22
PubChem Substance ID:
24879868
UNSPSC Code:
12352100
MDL number:
MFCD00041221
Assay:
96%

Key Documents

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Product Name

2-(4-Morpholino)ethyl isothiocyanate, 96%

InChI

1S/C7H12N2OS/c11-7-8-1-2-9-3-5-10-6-4-9/h1-6H2

SMILES string

S=C=NCCN1CCOCC1

InChI key

SDNSCXCXVQHBGH-UHFFFAOYSA-N

assay

96%

refractive index

n20/D 1.5380 (lit.)

bp

163 °C/10 mmHg (lit.)

density

1.129 g/mL at 25 °C (lit.)

functional group

amine
ether
isothiocyanate

storage temp.

2-8°C

Quality Level

100

Related Categories

Application

2-(4-Morpholino)ethyl isothiocyanate may be used to synthesize (R,S)-(2-morpholin-4-yl-ethyl)-thiocarbamic acid O-(5-[1,2] dithiolan-3-yl pentyl) ester hydrochloride.

signalword

Danger

Hazard Classifications

Acute Tox. 4 Oral - Eye Dam. 1 - Resp. Sens. 1 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

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

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKCS1343
MKCP7387
MKCL5088
MKBW7620V
MKBQ1524V

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Claude Guillonneau et al.
European journal of medicinal chemistry, 38(1), 1-11 (2003-02-21)
Molecules containing a dithiolane moiety are widely investigated due to their antioxidant properties. The archetypal representative of this class of compounds is lipoic acid and indeed the lipoic acid-dihydrolipoic acid couple is part of the antioxidant defence system of the

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