Snad sodium
Basic information
- CAS
300718-80-3- Standard SMILES
O=C([O-])CCCCCCCCCNC(=O)c1ccccc1[O-].[Na+].[Na+]- InChIKey
WPUFQQXXGHWGJT-UHFFFAOYSA-L- Molecular formula
- C17H23NNa2O4
- Average molar mass
- 351.3 g/mol
- Monoisotopic mass
- 351.14224678
Names & identifiers
- Preferred name
- Snad sodium
- IUPAC
- disodium;10-[(2-oxidobenzoyl)amino]decanoate
Names & synonyms
Snad sodium5JDX7XE1GXUNII-5JDX7XE1GX10-((2-Hydroxybenzoyl)amino)decanoate disodiumDecanoic acid, 10-((2-hydroxybenzoyl)amino)-, disodium saltDecanoic acid, 10-((2-hydroxybenzoyl)amino)-, sodium salt (1:2)300718-80-3SCHEMBL31125927
Database identifiers
- CAS
300718-80-3- PubChem CID
- 9841358
- UNII
- 5JDX7XE1GX
Properties
Computed structural properties
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 327
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Compound notes
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