TRANS-2-FLUORO-4-[[4-(4-PENTYLCYCLOHEXYL)PHENYL]ETHYNYL]BENZONITRILE

CAS No.
178628-30-3
CCD No.
CCD05637196
Formula
C26 H28 F N
MolWeight
373.512

Basic Information

Product Name: TRANS-2-FLUORO-4-[[4-(4-PENTYLCYCLOHEXYL)PHENYL]ETHYNYL]BENZONITRILE
CAS: 178628-30-3
English Synonyms: TRANS-2-FLUORO-4-[[4-(4-PENTYLCYCLOHEXYL)PHENYL]ETHYNYL]BENZONITRILE
MDL Number.: MFCD20488596
H bond acceptor: 1
H bond donor: 0
Smile: CCCCC[C@H]1CC[C@@H](CC1)c2ccc(cc2)C#Cc3ccc(c(c3)F)C#N
InChi: InChI=1S/C26H28FN/c1-2-3-4-5-20-8-13-23(14-9-20)24-15-10-21(11-16-24)6-7-22-12-17-25(19-28)26(27)18-22/h10-12,15-18,20,23H,2-5,8-9,13-14H2,1H3/t20-,23-
InChiKey: InChIKey=PLXDLWUVPTUOTH-JKIUYZKVSA-N

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