Basic information
- CAS
74216-73-2- Standard SMILES
CC(C)COC(=O)OC(=O)C(C)OC(=O)OCC(C)C- InChIKey
UMPAHXJIQCBVKB-UHFFFAOYSA-N- Molecular formula
- C13H22O7
- Average molar mass
- 290.31 g/mol
- Monoisotopic mass
- 290.13655304
Overview
inhibitor of lactate transport; structure in first source
Names & identifiers
- Preferred name
- Isobutylcarbonyllactyl anhydride
- IUPAC
- 2-methylpropoxycarbonyl 2-(2-methylpropoxycarbonyloxy)propanoate
- English name
- isobutylcarbonyllactyl anhydride
- Molecular formula
- C13H22O7
- Molecular weight
- 290.30958
Names & synonyms
Isobutylcarbonyllactyl anhydrideIBCLA74216-73-2Propanoic acid, 2-(((2-methylpropoxy)carbonyl)oxy)-, anhydride with 2-methylpropyl carbonateRefChem:149110SCHEMBL28395770DTXSID30995692bis(2-methylpropyl) 1-oxopropane-1,2-diyl biscarbonate
Database identifiers
- CAS
74216-73-2- PubChem CID
- 189809
- DTXSID
DTXSID30995692
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 336
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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