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TBF

Summary
Name:TERT-BUTYL FORMATE
Synonyms:TERTIARY BUTOXY CARBONYL
Formula:C5 H10 O2
Formal charge:0
Formula weight:102.132 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04tert-butyl formate
OpenEye OEToolkits1.5.0tert-butyl methanoate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=COC(C)(C)C
SMILES_CANONICALCACTVS3.341CC(C)(C)OC=O
SMILESCACTVS3.341CC(C)(C)OC=O
SMILES_CANONICALOpenEye OEToolkits1.5.0CC(C)(C)OC=O
SMILESOpenEye OEToolkits1.5.0CC(C)(C)OC=O
InChIInChI1.03InChI=1S/C5H10O2/c1-5(2,3)7-4-6/h4H,1-3H3
InChIKeyInChI1.03RUPAXCPQAAOIPB-UHFFFAOYSA-N

219869

PDB entries from 2024-05-15

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