52771-99-0
5-NITRO-1,3-DIHYDROISOBENZOFURAN
Name
5-NITRO-1,3-DIHYDROISOBENZOFURAN
Formula
C8 H7 N O3
MolWeight
165.147
1Identification
【Name】
5-NITRO-1,3-DIHYDROISOBENZOFURAN
【CAS】
【MDL】
MFCD09842489
【English Synonyms】
【Formula】
C8 H7 N O3
【MolWeight】
165.147
【Inchi】
InChI=1S/C8H7NO3/c10-9(11)8-2-1-6-4-12-5-7(6)3-8/h1-3H,4-5H2
【InChIKey】
InChIKey=VZIBAMYIHSHADC-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1[N+](=O)[O-])COC2
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-NITRO-1,3-DIHYDROISOBENZOFURAN.cml
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