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About This Item
Linear Formula:
BrC6H4NCS
CAS Number:
Molecular Weight:
214.08
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
878549
Assay:
97%
Form:
solid
assay
97%
form
solid
mp
56-58 °C (lit.)
SMILES string
Brc1ccc(cc1)N=C=S
InChI
1S/C7H4BrNS/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChI key
XQACWEBGSZBLRG-UHFFFAOYSA-N
Application
4-Bromophenyl isothiocyanate was used in the synthesis of 1-(4-bromophenyl)-3-ethyl-(1,2-dideoxy-D-glycero-α-D-galacto-heptofurano)[2,1-d]imidazolidine-2-thione.
signalword
Danger
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
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