Tert-butyl 3(rs),7-dimethyl-6-octenoate

HCID 22619086
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Basic information

Standard SMILES
CC(C)=CCCC(C)CC(=O)OC(C)(C)C
InChIKey
OZDVQVVZYCLOIY-UHFFFAOYSA-N
Molecular formula
C14H26O2
Average molar mass
226.35 g/mol

Names & identifiers

Preferred name
Tert-butyl 3(rs),7-dimethyl-6-octenoate
IUPAC
tert-butyl 3,7-dimethyloct-6-enoate

Names & synonyms

SCHEMBL7425253OZDVQVVZYCLOIY-UHFFFAOYSA-Ntert-butyl 3(rs),7-dimethyl-6-octenoate

Database identifiers

PubChem CID
22619086

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
16

Related reactions

3 records
New reaction record

Linked notes

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