57552-95-1
7-PHENYL-2,3,4,5-TETRAHYDRO-1H-1,4-DIAZEPIN-5-ONE
Name7-PHENYL-2,3,4,5-TETRAHYDRO-1H-1,4-DIAZEPIN-5-ONE
1Identification
【Name】
7-PHENYL-2,3,4,5-TETRAHYDRO-1H-1,4-DIAZEPIN-5-ONE
【CAS】
【MDL】
MFCD08695256
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C11 H12 N2 O
【pro_molWeight】
188.229
【Inchi】
InChI=1S/C11H12N2O/c14-11-8-10(12-6-7-13-11)9-4-2-1-3-5-9/h1-5,8,12H,6-7H2,(H,13,14)
【InChIKey】
InChIKey=QTBKTEDAGWNUEX-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)C2=CC(=O)NCCN2
【MOL File】
7-PHENYL-2,3,4,5-TET….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:3
XLogP3:0.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
7-PHENYL-2,3,4,5-TETRAHYDRO-1H-1,4-DIAZEPIN-5-ONE.cml