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560472

Sigma-Aldrich

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
MDL number:
MFCD00041221
UNSPSC Code:
12352100
PubChem Substance ID:
24879868
NACRES:
NA.22

Assay

96%

refractive index

n20/D 1.5380 (lit.)

bp

163 °C/10 mmHg (lit.)

density

1.129 g/mL at 25 °C (lit.)

storage temp.

2-8°C

SMILES string

S=C=NCCN1CCOCC1

InChI

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

InChI key

SDNSCXCXVQHBGH-UHFFFAOYSA-N

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.

Signal Word

Danger

Hazard Statements

H302,H315,H318,H334,H335

Hazard Classifications

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

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

230.0 °F - closed cup

Flash Point(C)

110 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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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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