Sodium nafcillin monohydrate
Properties
- Molecular formula
- C21H23N2NaO6S
- Molar mass
- 454.47 g/mol
- Exact mass
- 454.1175 Da
- logP
- 1.85Crippen estimate
- Polar surface area
- 130.9 Ų
- H-bond donors / acceptors
- 2 / 5
- Rotatable bonds
- 5
- Stereocentres
- R, R, Sin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
7177-50-6SMILES
CCOc1ccc2ccccc2c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C([O-])=O.O.[Na+]InChI
The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.
Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(2-ethoxy-1-naphthalenyl)carbonyl]amino]-3,3-dimethyl-7-oxo-, sodium salt, hydrate (1:1:1), (2S,5R,6R)-
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-(2-ethoxy-1-naphthamido)-3,3-dimethyl-7-oxo-, monosodium salt, monohydrate
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(2-ethoxy-1-naphthalenyl)carbonyl]amino]-3,3-dimethyl-7-oxo-, monosodium salt, monohydrate, [2S-(2α,5α,6β)]-
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(2-ethoxy-1-naphthalenyl)carbonyl]amino]-3,3-dimethyl-7-oxo-, monosodium salt, monohydrate, (2S,5R,6R)-
- Sodium 6-(2-ethoxy-1-naphthamido)penicillanate monohydrate
- Nafcillin sodium hydrate
Work with Sodium nafcillin monohydrate
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Methicillin sodium132-92-362 % similar
Sodium oxacillin monohydrate7240-38-258 % similar
Oxacillin sodium1173-88-255 % similar
Sodium cloxacillin monohydrate7081-44-954 % similar
Sodium dicloxacillin monohydrate13412-64-154 % similar
Penicillin G sodium69-57-854 % similar
Carbenicillin disodium4800-94-652 % similar
Cloxacillin sodium642-78-451 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.