86574-32-5
N-(2,6-DIMETHYLPHENYL)-1H-HEXAHYDROAZEPINE-1-ACETAMIDE MONOHYDROCHLORI DE
NameN-(2,6-DIMETHYLPHENYL)-1H-HEXAHYDROAZEPINE-1-ACETAMIDE MONOHYDROCHLORI DE
FormulaC16 H24 N2 O . Cl H
1Identification
【Name】
N-(2,6-DIMETHYLPHENYL)-1H-HEXAHYDROAZEPINE-1-ACETAMIDE MONOHYDROCHLORI DE
【CAS】
【MDL】
MFCD00490213
【English Synonyms】
【Formula】
C16 H24 N2 O . Cl H
【MolWeight】
296.84
【Inchi】
InChI=1S/C16H24N2O.ClH/c1-13-8-7-9-14(2)16(13)17-15(19)12-18-10-5-3-4-6-11-18;/h7-9H,3-6,10-12H2,1-2H3,(H,17,19);1H
【InChIKey】
InChIKey=KSBWLYWJTVBEIK-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1NC(=O)CN2CCCCCC2)C.Cl
【MOL File】
N-(2,6-DIMETHYLPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(2,6-DIMETHYLPHENYL)-1H-HEXAHYDROAZEPINE-1-ACETAMIDE MONOHYDROCHLORI DE.cml