Keyword(s): Food Contact Chemicals
Molecule Category Free-form
EPA CompTox DTXSID30987835

Structure

InChI Key RZEOGCQQWUAKHM-UHFFFAOYSA-N
Smiles C1CN1.ClCC1CO1
InChI
InChI=1S/C3H5ClO.C2H5N/c4-1-3-2-5-3;1-2-3-1/h3H,1-2H2;3H,1-2H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H10ClNO
Molecular Weight 135.05
AlogP 0.21
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 34.47
Molecular species None
Aromatic Rings 0.0
Heavy Atoms 8.0

Cross References

Resources Reference
CAS NUMBER 68307-89-1
NORMAN SUSDAT
PubChem 176404