757220-20-5
2-CHLORO-N-(3,4-DIHYDRO-2H-BENZO[B][1,4]DIOXEPIN-7-YL)-ACETAMIDE
Name2-CHLORO-N-(3,4-DIHYDRO-2H-BENZO[B][1,4]DIOXEPIN-7-YL)-ACETAMIDE
1Identification
【Name】
2-CHLORO-N-(3,4-DIHYDRO-2H-BENZO[B][1,4]DIOXEPIN-7-YL)-ACETAMIDE
【CAS】
【MDL】
MFCD06342744
【English Synonyms】
【Formula】
C11 H12 Cl N O3
【MolWeight】
241.673
【Inchi】
InChI=1S/C11H12ClNO3/c12-7-11(14)13-8-2-3-9-10(6-8)16-5-1-4-15-9/h2-3,6H,1,4-5,7H2,(H,13,14)
【InChIKey】
InChIKey=GJQLWCAWMVXADU-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1NC(=O)CCl)OCCCO2
【MOL File】
2-CHLORO-N-(3,4-DIHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-CHLORO-N-(3,4-DIHYDRO-2H-BENZO[B][1,4]DIOXEPIN-7-YL)-ACETAMIDE.cml