heptan-2-yl 2-bromanylethanoate

Systemtic Name: heptan-2-yl 2-bromanylethanoate Openeye Name: 1-methylhexyl 2-bromoacetate CAS Name: 2-bromoacetic acid heptan-2-yl ester IUPAC Name: heptan-2-yl 2-bromoacetate Traditional Name: 2-bromoacetic acid 1-methylhexyl ester Formula: C9H17BrO2 MolecularWeight: 237.13408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)OC(=O)CBr

Isomeric SMILES

CCCCCC(C)OC(=O)CBr

InChI

InChI=1S/C9H17BrO2/c1-3-4-5-6-8(2)12-9(11)7-10/h8H,3-7H2,1-2H3