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666580

Sigma-Aldrich

3-Amino-5-tert-butylisoxazole

97%

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About This Item

Empirical Formula (Hill Notation):
C7H12N2O
CAS Number:
55809-36-4
Molecular Weight:
140.18
MDL number:
MFCD00055620
UNSPSC Code:
12352100
PubChem Substance ID:
24884808
NACRES:
NA.22

assay

97%

form

solid

mp

110-114 °C

SMILES string

CC(C)(C)c1cc(N)no1

InChI

1S/C7H12N2O/c1-7(2,3)5-4-6(8)9-10-5/h4H,1-3H3,(H2,8,9)

InChI key

GGXGVZJHUKEJHO-UHFFFAOYSA-N

Application

Amination of aryl bromides catalyzed by Pd(dba)3 (Aldrich Catalog No. 328774) and Xantphos (Aldrich Catalog No. 526460).

pictograms

Exclamation mark
GHS07

signalword

Warning

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_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
BCBT2031
BCBK9695V
BCBJ8683V
BCBC5244V
BCBD1666V

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Synlett, 2331-2331 (2007)

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