Basic information
- CAS
729-87-3- Standard SMILES
CCOC(=O)C1C(C(=O)OCC)C1C(=O)OCC- InChIKey
ZWTRZSCYTXXULL-UHFFFAOYSA-N- Molecular formula
- C12H18O6
- Average molar mass
- 258.27 g/mol
- Monoisotopic mass
- 258.11033829
Names & identifiers
- Preferred name
- 1,2,3-Cyclopropanetricarboxylic acid, triethyl ester
- IUPAC
- triethyl cyclopropane-1,2,3-tricarboxylate
Names & synonyms
1,2,3-Cyclopropanetricarboxylic acid, triethyl ester729-87-3DTXSID10345373RefChem:214632DTXCID00296446triethyl cyclopropane-1,2,3-tricarboxylateOprea1_703110SCHEMBL12994228ZWTRZSCYTXXULL-UHFFFAOYSA-NAT55587Triethyl 1,2,3-cyclopropanetricarboxylate #Cyclopropane-1,2,3-tricarboxylic acid, triethyl ester
Show more names
TRANS,MESO-CYCLOPROPANE-1,2,3-TRICARBOXYLIC ACID TRIETHYL ESTER13949-99-0
Database identifiers
- CAS
729-87-3- PubChem CID
- 604010
- DTXSID
DTXSID10345373- Nikkaji
- J1.231.764F、J1.396.755E、J1.800.304J、J3.026.572F、J3.794.932I
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 279
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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