Sodium cloxacillin monohydrate
Properties
- Molecular formula
- C19H19ClN3NaO6S
- Molar mass
- 475.88 g/mol
- Exact mass
- 475.0581 Da
- Melting point
- 170 °C (decomposes)
- logP
- 1.92Crippen estimate
- Polar surface area
- 147.7 Ų
- H-bond donors / acceptors
- 2 / 6
- Rotatable bonds
- 4
- 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
7081-44-9SMILES
Cc1onc(-c2ccccc2Cl)c1C(=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
7 names
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]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-[[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]amino]-3,3-dimethyl-7-oxo-, monosodium salt, monohydrate, (2S,5R,6R)-
- 3-(o-Chlorophenyl)-5-methyl-4-isoxazolyl penicillin sodium salt monohydrate
- Sodium 6-[3-(o-Chlorophenyl)-5-methyl-4-isoxazolecarboxamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrate
- Cloxacillin sodium hydrate
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]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-[3-(o-chlorophenyl)-5-methyl-4-isoxazolecarboxamido]-3,3-dimethyl-7-oxo-, monosodium salt, monohydrate
Work with Sodium cloxacillin 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
Sodium dicloxacillin monohydrate13412-64-187 % similar
Sodium oxacillin monohydrate7240-38-281 % similar
Oxacillin sodium1173-88-277 % similar
Flucloxacillin sodium1847-24-177 % similar
Methicillin sodium132-92-357 % similar
Sodium nafcillin monohydrate7177-50-654 % similar
Nafcillin sodium985-16-051 % similar
Carbenicillin disodium4800-94-650 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.