Diisopropyl glutarate
Basic information
- CAS
71340-46-0- Standard SMILES
CC(C)OC(=O)CCCC(=O)OC(C)C- InChIKey
MSQKMFXJFBXZNQ-UHFFFAOYSA-N- Molecular formula
- C11H20O4
- Average molar mass
- 216.27 g/mol
- Monoisotopic mass
- 216.13615912
Names & identifiers
- Preferred name
- Diisopropyl glutarate
- IUPAC
- dipropan-2-yl pentanedioate
- English name
- diisopropyl glutarate
- Molecular formula
- C11H20O4
- Molecular weight
- 216.27
Names & synonyms
Diisopropyl glutarate71340-46-0Pentanedioic acid, bis(1-methylethyl) esterisopropyl glutarateNSC67891EINECS 275-345-5AI3-06041Glutarsaure-diisopropylesterSCHEMBL18619Di(propan-2-yl) pentanedioateGlutaric acid, diisopropyl esterbis(1-methylethyl) pentanedioate
Show more names
Glutaric acid diisopropyl esterPentanedioic acid diisopropyl esterPentanedioic acid, 1,5-bis(1-methylethyl) ester
DTXSID20221538NSC 67891NSC-67891NS00037192Q65224961
Database identifiers
- CAS
71340-46-0- PubChem CID
- 96330
- DTXSID
DTXSID20221538- EC Number
- 275-345-5
- Nikkaji
- J294.968G
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 187
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
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Related reactions
4 records
Compound notes
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