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5PP

Summary
Name:5-PENTYL-2-PHENOXYPHENOL
Formula:C17 H20 O2
Formal charge:0
Formula weight:256.339 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.045-pentyl-2-phenoxyphenol
OpenEye OEToolkits1.5.05-pentyl-2-phenoxy-phenol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O(c1ccccc1)c2ccc(cc2O)CCCCC
SMILES_CANONICALCACTVS3.341CCCCCc1ccc(Oc2ccccc2)c(O)c1
SMILESCACTVS3.341CCCCCc1ccc(Oc2ccccc2)c(O)c1
SMILES_CANONICALOpenEye OEToolkits1.5.0CCCCCc1ccc(c(c1)O)Oc2ccccc2
SMILESOpenEye OEToolkits1.5.0CCCCCc1ccc(c(c1)O)Oc2ccccc2
InChIInChI1.03InChI=1S/C17H20O2/c1-2-3-5-8-14-11-12-17(16(18)13-14)19-15-9-6-4-7-10-15/h4,6-7,9-13,18H,2-3,5,8H2,1H3
InChIKeyInChI1.03OJLYTHOKCYLPMA-UHFFFAOYSA-N

223532

數據於2024-08-07公開中

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