866138-11-6
5-HEXANOYL-1,3,4,5-TETRAHYDRO-2H-1,5-BENZODIAZEPIN-2-ONE
Name5-HEXANOYL-1,3,4,5-TETRAHYDRO-2H-1,5-BENZODIAZEPIN-2-ONE
1Identification
【Name】
5-HEXANOYL-1,3,4,5-TETRAHYDRO-2H-1,5-BENZODIAZEPIN-2-ONE
【CAS】
【MDL】
MFCD04126153
【English Synonyms】
【Formula】
C15 H20 N2 O2
【MolWeight】
260.335
【Inchi】
InChI=1S/C15H20N2O2/c1-2-3-4-9-15(19)17-11-10-14(18)16-12-7-5-6-8-13(12)17/h5-8H,2-4,9-11H2,1H3,(H,16,18)
【InChIKey】
InChIKey=LCVNEYOALVIOBL-UHFFFAOYSA-N
【SMILES】
CCCCCC(=O)N1CCC(=O)Nc2c1cccc2
【MOL File】
5-HEXANOYL-1,3,4,5-T….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-HEXANOYL-1,3,4,5-TETRAHYDRO-2H-1,5-BENZODIAZEPIN-2-ONE.cml