Completing data — usually done within a minute
Basic information
- CAS
51318-98-0- Standard SMILES
O=C(O)CC1(C(=O)O)CC2C=CC1C2- InChIKey
YZGFGXBZXHCJPU-UHFFFAOYSA-N- Molecular formula
- C10H12O4
- Average molar mass
- 196.2 g/mol
- Monoisotopic mass
- 196.07355886
Names & identifiers
- Preferred name
- CID 303490
- IUPAC
- 2-(carboxymethyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Names & synonyms
MLS00310699751318-98-0NSC191879SCHEMBL75380CHEMBL1888768DTXSID50307516YZGFGXBZXHCJPU-UHFFFAOYSA-NNSC-1918795-carboxy-5-carboxymethyl-2-norborneneSMR0018218782-(carboxymethyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Database identifiers
- CAS
51318-98-0- PubChem CID
- 303490
- DTXSID
DTXSID50307516- ChEMBL
CHEMBL1888768
Properties
Computed structural propertiesFilling in
- XLogP
- 0.5
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 320
Related reactions
1 records
Compound notes
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