501361-78-0
5-ETHYL-3-METHYL-2,4-DINITRO-PHENOL
Name5-ETHYL-3-METHYL-2,4-DINITRO-PHENOL
1Identification
【Name】
5-ETHYL-3-METHYL-2,4-DINITRO-PHENOL
【CAS】
【MDL】
MFCD18969183
【English Synonyms】
【Formula】
C9 H10 N2 O5
【MolWeight】
226.187
【Inchi】
InChI=1S/C9H10N2O5/c1-3-6-4-7(12)9(11(15)16)5(2)8(6)10(13)14/h4,12H,3H2,1-2H3
【InChIKey】
InChIKey=GYWZTPSPWIAYPR-UHFFFAOYSA-N
【SMILES】
CCc1cc(c(c(c1[N+](=O)[O-])C)[N+](=O)[O-])O
【MOL File】
5-ETHYL-3-METHYL-2,4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-ETHYL-3-METHYL-2,4-DINITRO-PHENOL.cml