63959-33-1
4-(4-CHLOROPHENYL)-4-HYDROXY-ALPHA,ALPHA-DIPHENYL-1-PIPERIDINEBUTANENITRILE
Name4-(4-CHLOROPHENYL)-4-HYDROXY-ALPHA,ALPHA-DIPHENYL-1-PIPERIDINEBUTANENITRILE
1Identification
【Name】
4-(4-CHLOROPHENYL)-4-HYDROXY-ALPHA,ALPHA-DIPHENYL-1-PIPERIDINEBUTANENITRILE
【CAS】
【MDL】
MFCD16293800
【English Synonyms】
【Formula】
C27 H26 Cl N O
【MolWeight】
415.961
【Inchi】
InChI=1S/C27H26ClNO/c1-2-17-27(23-9-5-3-6-10-23,24-11-7-4-8-12-24)29-20-18-26(30,19-21-29)22-13-15-25(28)16-14-22/h1,3-16,30H,17-21H2
【InChIKey】
InChIKey=XIJGLGCEWTUHRN-UHFFFAOYSA-N
【SMILES】
C#CCC(c1ccccc1)(c2ccccc2)N3CCC(CC3)(c4ccc(cc4)Cl)O
【MOL File】
4-(4-CHLOROPHENYL)-4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(4-CHLOROPHENYL)-4-HYDROXY-ALPHA,ALPHA-DIPHENYL-1-PIPERIDINEBUTANENITRILE.cml