Structural Complex
Chemical ID: A1JJJ
IUPAC Name: dichloromethane
Formal Charge: 0
Type: non-polymer
Physiochemical Descriptor:
Formula: C H2 Cl2
Molecular weight: 84.933
Hydrogen Bond Acceptor: 0
Hydrogen Bond Donor: 0
Rotatable Bonds: 0
Heavy Atoms: 3
Systematic name
Program Version Descriptor
OpenEye OEToolkits 2.0.7 bis(chloranyl)methane
Chemical Descriptors
Type Program Version Descriptor
InChI InChI 1.06 InChI=1S/CH2Cl2/c2-1-3/h1H2
InChIKey InChI 1.06 YMWUJEATGCHHMB-UHFFFAOYSA-N
SMILES_CANONICAL CACTVS 3.385 ClCCl
SMILES CACTVS 3.385 ClCCl
SMILES_CANONICAL OpenEye OEToolkits 2.0.7 C(Cl)Cl
SMILES OpenEye OEToolkits 2.0.7 C(Cl)Cl
Chemical Database Mapping
Database Reference ID
PubChem 6344
ChEBI 15767
SureChEMBL SCHEMBL18247337,SCHEMBL493
HMDB HMDB0031548
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