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MHN

Summary
Name:6-METHYLHEPTAN-1-OL
Synonyms:METHYL HEPTANOL
Formula:C8 H18 O
Formal charge:0
Formula weight:130.228 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.046-methylheptan-1-ol
OpenEye OEToolkits1.5.06-methylheptan-1-ol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04OCCCCCC(C)C
SMILES_CANONICALCACTVS3.341CC(C)CCCCCO
SMILESCACTVS3.341CC(C)CCCCCO
SMILES_CANONICALOpenEye OEToolkits1.5.0CC(C)CCCCCO
SMILESOpenEye OEToolkits1.5.0CC(C)CCCCCO
InChIInChI1.03InChI=1S/C8H18O/c1-8(2)6-4-3-5-7-9/h8-9H,3-7H2,1-2H3
InChIKeyInChI1.03BWDBEAQIHAEVLV-UHFFFAOYSA-N

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PDB entries from 2024-07-17

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