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CNR

Summary
Name:(2S)-2-CHLOROPROPANOIC ACID
Synonyms:2-MONOCHLOROPRAPANATE
Formula:C3 H5 Cl O2
Formal charge:0
Formula weight:108.524 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04(2S)-2-chloropropanoic acid
OpenEye OEToolkits1.5.0(2S)-2-chloropropanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04ClC(C(=O)O)C
SMILES_CANONICALCACTVS3.341C[C@H](Cl)C(O)=O
SMILESCACTVS3.341C[CH](Cl)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0C[C@@H](C(=O)O)Cl
SMILESOpenEye OEToolkits1.5.0CC(C(=O)O)Cl
InChIInChI1.03InChI=1S/C3H5ClO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6)/t2-/m0/s1
InChIKeyInChI1.03GAWAYYRQGQZKCR-REOHCLBHSA-N

217705

PDB entries from 2024-03-27

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