701932-21-0
1H-AZEPINE-1-CARBOXAMIDE, N-(3-ACETYLPHENYL)HEXAHYDRO-
Name1H-AZEPINE-1-CARBOXAMIDE, N-(3-ACETYLPHENYL)HEXAHYDRO-
1Identification
【Name】
1H-AZEPINE-1-CARBOXAMIDE, N-(3-ACETYLPHENYL)HEXAHYDRO-
【CAS】
【MDL】
MFCD04228710
【English Synonyms】
【Formula】
C15 H20 N2 O2
【MolWeight】
260.335
【Inchi】
InChI=1S/C15H20N2O2/c1-12(18)13-7-6-8-14(11-13)16-15(19)17-9-4-2-3-5-10-17/h6-8,11H,2-5,9-10H2,1H3,(H,16,19)
【InChIKey】
InChIKey=PWCCIYWPJXPVPL-UHFFFAOYSA-N
【SMILES】
CC(=O)c1cccc(c1)NC(=O)N2CCCCCC2
【MOL File】
1H-AZEPINE-1-CARBOXA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H-AZEPINE-1-CARBOXAMIDE, N-(3-ACETYLPHENYL)HEXAHYDRO-.cml