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About This Item
Empirical Formula (Hill Notation):
C4H4ClN3O · xH2O
CAS Number:
Molecular Weight:
145.55 (anhydrous basis)
EC Number:
214-785-4
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
509212
MDL number:
assay
98%
mp
252 °C (dec.) (lit.)
SMILES string
O.Nc1nc(O)cc(Cl)n1
InChI
1S/C4H4ClN3O.H2O/c5-2-1-3(9)8-4(6)7-2;/h1H,(H3,6,7,8,9);1H2
InChI key
KBQIJULVUFJCMD-UHFFFAOYSA-N
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - 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, Gloves
Regulatory Information
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