843667-17-4
1-(1,2,3,4-TETRAHYDROCYCLOPENT[B]INDOL-3-YL)-ETHANONE
Name1-(1,2,3,4-TETRAHYDROCYCLOPENT[B]INDOL-3-YL)-ETHANONE
1Identification
【Name】
1-(1,2,3,4-TETRAHYDROCYCLOPENT[B]INDOL-3-YL)-ETHANONE
【CAS】
【MDL】
MFCD16877852
【English Synonyms】
【Formula】
C13 H13 N O
【MolWeight】
199.252
【Inchi】
InChI=1S/C13H13NO/c1-8(15)9-6-7-11-10-4-2-3-5-12(10)14-13(9)11/h2-5,9,14H,6-7H2,1H3
【InChIKey】
InChIKey=ZWYIZHYMDKEMAC-UHFFFAOYSA-N
【SMILES】
CC(=O)C1CCc2c1[nH]c3c2cccc3
【MOL File】
1-(1,2,3,4-TETRAHYDR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(1,2,3,4-TETRAHYDROCYCLOPENT[B]INDOL-3-YL)-ETHANONE.cml