592550-34-0
1H-INDOLE-3-CARBOXALDEHYDE,2-METHYL-1-[(2-NITROPHENYL)METHYL]-
Name1H-INDOLE-3-CARBOXALDEHYDE,2-METHYL-1-[(2-NITROPHENYL)METHYL]-
1Identification
【Name】
1H-INDOLE-3-CARBOXALDEHYDE,2-METHYL-1-[(2-NITROPHENYL)METHYL]-
【CAS】
【MDL】
MFCD03906271
【English Synonyms】
【Formula】
C17 H14 N2 O3
【MolWeight】
294.309
【Inchi】
InChI=1S/C17H14N2O3/c1-12-15(11-20)14-7-3-5-9-17(14)18(12)10-13-6-2-4-8-16(13)19(21)22/h2-9,11H,10H2,1H3
【InChIKey】
InChIKey=WDORVYPKMJWDTQ-UHFFFAOYSA-N
【SMILES】
Cc1c(c2ccccc2n1Cc3ccccc3[N+](=O)[O-])C=O
【MOL File】
1H-INDOLE-3-CARBOXAL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H-INDOLE-3-CARBOXALDEHYDE,2-METHYL-1-[(2-NITROPHENYL)METHYL]-.cml