Basic information
- Standard SMILES
O=C([O-])c1scc(CN2CCOCC2)c1Cl.[Na+]- InChIKey
BLWWPCSQGKUJJB-UHFFFAOYSA-M- Molecular formula
- C10H11ClNNaO3S
- Average molar mass
- 283.71 g/mol
- Monoisotopic mass
- 283.0045864
Names & identifiers
- Preferred name
- Sodium 3-chloro4-(morpholin-4-yl)methyl-2-thiophene carboxylate
- IUPAC
- sodium 3-chloro-4-(morpholin-4-ylmethyl)thiophene-2-carboxylate
Names & synonyms
SCHEMBL6594051BLWWPCSQGKUJJB-UHFFFAOYSA-Msodium 3-chloro-4-(morpholin-4-yl)methyl-2-thiophene carboxylatesodium 3-chloro4-(morpholin-4-yl)methyl-2-thiophene carboxylate
Database identifiers
- PubChem CID
- 23701467
Properties
Computed structural properties
- Topological polar surface area
- 80.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 266
Related reactions
2 records
Compound notes
Loading…