124390-37-0
11-METHYL-6-NITROCHRYSENE
Name11-METHYL-6-NITROCHRYSENE
1Identification
【Name】
11-METHYL-6-NITROCHRYSENE
【CAS】
【MDL】
MFCD02751883
【English Synonyms】
【Formula】
C19 H13 N O2
【MolWeight】
287.317
【Inchi】
InChI=1S/C19H13NO2/c1-12-10-13-6-2-3-7-14(13)17-11-18(20(21)22)15-8-4-5-9-16(15)19(12)17/h2-11H,1H3
【InChIKey】
InChIKey=OMBRRTHRPGDGPK-UHFFFAOYSA-N
【SMILES】
Cc1cc2ccccc2c3c1c4ccccc4c(c3)[N+](=O)[O-]
【MOL File】
11-METHYL-6-NITROCHR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
11-METHYL-6-NITROCHRYSENE.cml