2,2-difluoro-3-oxobutanal

2D Structure
3D Structure
Source:
General
Identifier MM02193
SMILES CC(=O)C(F)(F)C=O
InChIKey NSIFGFWJJQVOBE-UHFFFAOYSA-N
MW [Da] 122.07

Automatically obtained from RDkit software.

LogP 0.41

Automatically obtained from RDkit software.

Links

PubChem

54127989

DrugBank

N/A

ChEBI

N/A

PDB

N/A

ChEMBL

N/A

No data

Methods

Computed
QSAR
Simulated
Coarse grain MD

No data

No transporter data found.