Chem Chloroacetyl Chloride Molychem | Cheminformatics
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2D Structure

Chloroacetyl Chloride


  • SKU Code: CH140814
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Chemical Name - Chloroacetyl Chloride
Mol Weight - 112.943
Smiles - O=C(CCl)Cl
Property Name Property Value
Mol NameChloroacetyl Chloride
Molweight112.943
Monoisotopic Mass111.948269
Clogp0.3121
Clogs-0.936
H Acceptors1
Total Surface Area75.85
Relative Psa0.17192
Polar Surface Area17.07
Druglikeness-12.427
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritantlow
Shape Index0.8
Molecular Flexibility0.61655
Molecular Complexity0.69315
Fragments1
Non H Atoms5
Non Ch Atoms3
Electronegative Atoms3
Rotatable Bonds1
Sp3 Atoms1
SmilesO=C(CCl)Cl
InChIKeyInChI=1S/C2H2Cl2O/c3-1-2(4)5/h1H2
InChIVGCXGMAHQTYDJK-UHFFFAOYSA-N

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