5-(Bromomethyl)-3-phenylisoxazole Structure

5-(Bromomethyl)-3-phenylisoxazole

Chemical Properties

Melting point 82.5-85
Boiling point 143-145 °C(Press: 2 Torr)
Density  1.4780 g/cm3
storage temp.  2-8°C
form  solid
pka -3.18±0.50(Predicted)
InChI 1S/C10H8BrNO/c11-7-9-6-10(12-13-9)8-4-2-1-3-5-8/h1-6H,7H2
InChIKey ANRMBFFXQKJEIS-UHFFFAOYSA-N
SMILES BrCc1cc(no1)-c2ccccc2
CAS DataBase Reference 2039-50-1
UNSPSC Code 12352200
NACRES NA.21

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302
Precautionary statements P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes  C,Xn
Risk Statements  22
WGK Germany  3
Hazard Note  Corrosive
HS Code  2934999090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
NFPA 704:
1
3 0

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