1023-85-4
3-METHYL-1-PHENYL-1,3,8-TRIAZASPIRO[4,5]DECAN-4-ONE HYDROCHLORIDE
Name3-METHYL-1-PHENYL-1,3,8-TRIAZASPIRO[4,5]DECAN-4-ONE HYDROCHLORIDE
FormulaC14 H19 N3 O . Cl H
1Identification
【Name】
3-METHYL-1-PHENYL-1,3,8-TRIAZASPIRO[4,5]DECAN-4-ONE HYDROCHLORIDE
【CAS】
【MDL】
MFCD01679361
【English Synonyms】
【Formula】
C14 H19 N3 O . Cl H
【MolWeight】
281.785
【Inchi】
InChI=1S/C14H19N3O.ClH/c1-16-11-17(12-5-3-2-4-6-12)14(13(16)18)7-9-15-10-8-14;/h2-6,15H,7-11H2,1H3;1H
【InChIKey】
InChIKey=IFYWBEDKWLNJTM-UHFFFAOYSA-N
【SMILES】
CN1CN(C2(C1=O)CCNCC2)c3ccccc3.Cl
【MOL File】
3-METHYL-1-PHENYL-1,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-METHYL-1-PHENYL-1,3,8-TRIAZASPIRO[4,5]DECAN-4-ONE HYDROCHLORIDE.cml