4-chloranylbutan-2-yl 3,3-dimethylbutanoate

Systemtic Name: 4-chloranylbutan-2-yl 3,3-dimethylbutanoate Openeye Name: (3-chloro-1-methyl-propyl) 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid 4-chlorobutan-2-yl ester IUPAC Name: 4-chlorobutan-2-yl 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid (3-chloro-1-methyl-propyl) ester Formula: C10H19ClO2 MolecularWeight: 206.70966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCl)OC(=O)CC(C)(C)C

Isomeric SMILES

CC(CCCl)OC(=O)CC(C)(C)C

InChI

InChI=1S/C10H19ClO2/c1-8(5-6-11)13-9(12)7-10(2,3)4/h8H,5-7H2,1-4H3