5301-03-1
5-(BROMOMETHYL)-3-(3-NITROPHENYL)ISOXAZOLE
Name5-(BROMOMETHYL)-3-(3-NITROPHENYL)ISOXAZOLE
1Identification
【Name】
5-(BROMOMETHYL)-3-(3-NITROPHENYL)ISOXAZOLE
【CAS】
【MDL】
MFCD13193188
【English Synonyms】
【Formula】
C10 H7 Br N2 O3
【MolWeight】
283.08
【Inchi】
InChI=1S/C10H7BrN2O3/c11-6-9-5-10(12-16-9)7-2-1-3-8(4-7)13(14)15/h1-5H,6H2
【InChIKey】
InChIKey=XXBQYLWWZAASLO-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)[N+](=O)[O-])c2cc(on2)CBr
【MOL File】
5-(BROMOMETHYL)-3-(3….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
5-(BROMOMETHYL)-3-(3-NITROPHENYL)ISOXAZOLE.cml