Basic information
- Standard SMILES
CC(C)(C)OC(=O)C1CC2C=CC1C2.COC(=O)C1C2C=CC(C2)C1C(=O)O.O=C(O)C1CC2C=CC1C2.O=C1C=CC(=O)O1.O=C1OC(=O)C2C1[C@@H]1C=C[C@H]2C1- InChIKey
CJIPNPLMKCPBRJ-PUTYQDSZSA-N- Molecular formula
- C43H50O14
- Average molar mass
- 790.8 g/mol
- Monoisotopic mass
- 790.32005626
Names & identifiers
- Preferred name
- cis-5-Norbornene-endo-2,3-dicarboxylic Anhydride tert-butyl 5-Norbornene-2-carboxylate maleic Anhydride mono-methyl cis-5-Norbornene-endo-2,3-dicarboxylate 5-norbornene-2-carboxylic Acid
- IUPAC
- bicyclo[2.2.1]hept-5-ene-2-carboxylic acid;tert-butyl bicyclo[2.2.1]hept-5-ene-2-carboxylate;furan-2,5-dione;3-methoxycarbonylbicyclo[2.2.1]hept-5-ene-2-carboxylic acid;(1R,7S)-4-oxatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Names & synonyms
CJIPNPLMKCPBRJ-PUTYQDSZSA-Ncis-5-Norbornene-endo-2,3-dicarboxylic Anhydride tert-butyl 5-Norbornene-2-carboxylate maleic Anhydride mono-methyl cis-5-Norbornene-endo-2,3-dicarboxylate 5-norbornene-2-carboxylic Acid
Database identifiers
- PubChem CID
- 131723902
Properties
Computed structural properties
- Topological polar surface area
- 214 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 7
- Heavy atoms
- 57
- Formal charge
- 0
- Complexity
- 1,180
Related reactions
2 records
Compound notes
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