936630-45-4
1-(1,1-DIMETHYLETHYL)HEXAHYDRO-3-METHYL-2H-1,4-DIAZEPIN-2-ONE
Name1-(1,1-DIMETHYLETHYL)HEXAHYDRO-3-METHYL-2H-1,4-DIAZEPIN-2-ONE
1Identification
【Name】
1-(1,1-DIMETHYLETHYL)HEXAHYDRO-3-METHYL-2H-1,4-DIAZEPIN-2-ONE
【CAS】
【MDL】
MFCD14707900
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C10 H20 N2 O
【pro_molWeight】
184.281
【Inchi】
InChI=1S/C10H20N2O/c1-8-9(13)12(10(2,3)4)7-5-6-11-8/h8,11H,5-7H2,1-4H3
【InChIKey】
InChIKey=MMTOVDSAVSKRMM-UHFFFAOYSA-N
【SMILES】
CC1C(=O)N(CCCN1)C(C)(C)C
【MOL File】
1-(1,1-DIMETHYLETHYL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:3
XLogP3:1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-(1,1-DIMETHYLETHYL)HEXAHYDRO-3-METHYL-2H-1,4-DIAZEPIN-2-ONE.cml