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Merck
CN

253723

o-Tolyl isothiocyanate

99%

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About This Item

Linear Formula:
CH3C6H4NCS
CAS Number:
614-69-7
Molecular Weight:
149.21
UNSPSC Code:
12352100
PubChem Substance ID:
24855323
EC Number:
210-390-6
MDL number:
MFCD00004802

Key Documents

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InChI key

JYKYYPPZLPVIBY-UHFFFAOYSA-N

InChI

1S/C8H7NS/c1-7-4-2-3-5-8(7)9-6-10/h2-5H,1H3

SMILES string

Cc1ccccc1N=C=S

assay

99%

refractive index

n20/D 1.6361 (lit.)

bp

239 °C (lit.)

density

1.115 g/mL at 25 °C (lit.)

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

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

wgk

WGK 3

flash_point_f

226.4 °F - closed cup

flash_point_c

108 °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
08914KH
08812CU
06124AR
03909MZ
03403KG

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Hang Zhang et al.
Carbohydrate polymers, 219, 219-228 (2019-06-04)
Coreopsis tinctoria is being widely cultivated in Xinjiang of China, whose consumption is known to prevent diabetes and neurodegenerative diseases. To elucidate the bioactive ingredients responsible for these benefits, the alkaline soluble crude polysaccharide (CTB) was isolated from C. tinctoria.
Fenghua Li et al.
Phytochemistry, 163, 23-32 (2019-04-16)
The 95% ethanol extract and its EtOAc and n-BuOH fractions obtained from the leaves and twigs of Schefflera rubriflora C. J. Tseng & G. Hoo showed significant inhibitory activities (33.6%, 35.7% and 40.6%, respectively) against croton oil-induced ear inflammation in
Yue Hu et al.
Natural product research, 32(19), 2312-2318 (2017-12-05)
A new C-glycosyl flavone, Chrysin-8-C-(2″-O-β-6-deoxy-glucopyranosyl)-β-D-glucopyranoside (1), a new neolignan glycoside, citrusin G (2), as well as 15 known compounds (3-17) were isolated from the peel of Passiflora edulis Sims. The structure determinations were primarily based on comprehensive spectroscopic analyses, and
Juan Li et al.
Journal of ginseng research, 43(3), 377-384 (2019-07-17)
Inflammation is widespread in the clinical pathology and closely associated to the progress of many diseases. Triterpenoid saponins as a key group of active ingredients in Panax notoginseng (Burk.) F.H. Chen were demonstrated to show antiinflammatory effects. However, the chemical
Aldjia Hadroug et al.
Natural product research, 33(9), 1334-1339 (2018-05-17)
A new coumarin-secoiridoid diglucoside, named Isofraxisecoside, was isolated from the stem bark of Fraxinus xanthoxyloides (G. Don) Wall. ex A. DC. along with nine known compounds. The structure of new compound has been determined on the basis of 1H, 13C
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