53391-21-2
2-CHLORO-1-(1-ETHYL-5-NITRO-1H-PYRROL-2-YL)-ETHANONE
Name2-CHLORO-1-(1-ETHYL-5-NITRO-1H-PYRROL-2-YL)-ETHANONE
1Identification
【Name】
2-CHLORO-1-(1-ETHYL-5-NITRO-1H-PYRROL-2-YL)-ETHANONE
【CAS】
【MDL】
MFCD13173350
【English Synonyms】
【Formula】
C8 H9 Cl N2 O3
【MolWeight】
216.623
【Inchi】
InChI=1S/C8H9ClN2O3/c1-2-10-6(7(12)5-9)3-4-8(10)11(13)14/h3-4H,2,5H2,1H3
【InChIKey】
InChIKey=YRIBINMXSWLLOO-UHFFFAOYSA-N
【SMILES】
CCn1c(ccc1[N+](=O)[O-])C(=O)CCl
【MOL File】
2-CHLORO-1-(1-ETHYL-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CHLORO-1-(1-ETHYL-5-NITRO-1H-PYRROL-2-YL)-ETHANONE.cml