53391-20-1
2-CHLORO-1-(1-METHYL-5-NITRO-1H-PYRROL-YL)-ETHANONE
Name2-CHLORO-1-(1-METHYL-5-NITRO-1H-PYRROL-YL)-ETHANONE
1Identification
【Name】
2-CHLORO-1-(1-METHYL-5-NITRO-1H-PYRROL-YL)-ETHANONE
【CAS】
【MDL】
MFCD21608928
【English Synonyms】
【Formula】
C7 H7 Cl N2 O3
【MolWeight】
202.596
【Inchi】
InChI=1S/C7H7ClN2O3/c1-9-5(6(11)4-8)2-3-7(9)10(12)13/h2-3H,4H2,1H3
【InChIKey】
InChIKey=XDZGVPOPBIGUOU-UHFFFAOYSA-N
【SMILES】
Cn1c(ccc1[N+](=O)[O-])C(=O)CCl
【MOL File】
2-CHLORO-1-(1-METHYL….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-METHYL-5-NITRO-1H-PYRROL-YL)-ETHANONE.cml