Basic information
- CAS
34703-74-7- Standard SMILES
CCCCCOCn1cnc2ccccc21.O=C(O)C(=O)O- InChIKey
MADVDUHYOPSWAG-UHFFFAOYSA-N- Molecular formula
- C15H20N2O5
- Average molar mass
- 308.33 g/mol
- Monoisotopic mass
- 308.13722174
Names & identifiers
- Preferred name
- Benzimidazole, 1-pentoxymethyl-, oxalate
- IUPAC
- oxalic acid;1-(pentoxymethyl)benzimidazole
Names & synonyms
1-Pentoxymethylbenzimidazole oxalateBenzimidazole, 1-pentoxymethyl-, oxalate34703-74-7DTXSID80188259RefChem:325829DTXCID60110750Oxalic acid--1-[(pentyloxy)methyl]-1H-1,3-benzimidazole (1/1)
Database identifiers
- CAS
34703-74-7- PubChem CID
- 214968
- DTXSID
DTXSID80188259
Properties
Computed structural properties
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 270
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…