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About This Item
Empirical Formula (Hill Notation):
C7H12N2O
CAS Number:
Molecular Weight:
140.18
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Product Name
3-Amino-5-tert-butylisoxazole, 97%
InChI
1S/C7H12N2O/c1-7(2,3)5-4-6(8)9-10-5/h4H,1-3H3,(H2,8,9)
SMILES string
CC(C)(C)c1cc(N)no1
InChI key
GGXGVZJHUKEJHO-UHFFFAOYSA-N
assay
97%
form
solid
mp
110-114 °C
Application
Amination of aryl bromides catalyzed by Pd(dba)3 (Aldrich Catalog No. 328774) and Xantphos (Aldrich Catalog No. 526460).
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - 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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Synlett, 2331-2331 (2007)
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