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2MY

Summary
Name:2,6-dimethylphenol
Formula:C8 H10 O
Formal charge:0
Formula weight:122.164 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042,6-dimethylphenol
OpenEye OEToolkits1.5.02,6-dimethylphenol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Oc1c(cccc1C)C
SMILES_CANONICALCACTVS3.341Cc1cccc(C)c1O
SMILESCACTVS3.341Cc1cccc(C)c1O
SMILES_CANONICALOpenEye OEToolkits1.5.0Cc1cccc(c1O)C
SMILESOpenEye OEToolkits1.5.0Cc1cccc(c1O)C
InChIInChI1.03InChI=1S/C8H10O/c1-6-4-3-5-7(2)8(6)9/h3-5,9H,1-2H3
InChIKeyInChI1.03NXXYKOUNUYWIHA-UHFFFAOYSA-N

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건을2024-11-06부터공개중

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