546038
2-Amino-4-hydroxy-6-trifluoromethylpyrimidine
97%
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About This Item
Empirical Formula (Hill Notation):
C5H4F3N3O
CAS Number:
Molecular Weight:
179.10
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
assay
97%
mp
289.5-293.5 °C (lit.)
SMILES string
Nc1nc(O)cc(n1)C(F)(F)F
InChI
1S/C5H4F3N3O/c6-5(7,8)2-1-3(12)11-4(9)10-2/h1H,(H3,9,10,11,12)
InChI key
ZEPSVMLZBXDPGU-UHFFFAOYSA-N
General description
Optimized molecular geometry, force constants and vibrational frequencies of 2-amino-4-hydroxy-6-trifluoromethylpyrimidine (AHFMP) have been evaluated by density functional theory (DFT).
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
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