52415-00-6
4-IODO-2-METHYL-1-NITROBENZENE
Name
4-IODO-2-METHYL-1-NITROBENZENE
Formula
C7 H6 I N O2
MolWeight
263.029
1Identification
【Name】
4-IODO-2-METHYL-1-NITROBENZENE
【CAS】
【MDL】
MFCD08234827
【English Synonyms】
【Formula】
C7 H6 I N O2
【MolWeight】
263.029
【Inchi】
InChI=1S/C7H6INO2/c1-5-4-6(8)2-3-7(5)9(10)11/h2-4H,1H3
【InChIKey】
InChIKey=KLFPWAALRHXSRR-UHFFFAOYSA-N
【SMILES】
Cc1cc(ccc1[N+](=O)[O-])I
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-IODO-2-METHYL-1-NITROBENZENE.cml
Quick Release
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