cloxacillin sulfone

Modify Date: 2025-08-25 01:19:29

cloxacillin sulfone Structure
cloxacillin sulfone structure
Common Name cloxacillin sulfone
CAS Number 76788-83-5 Molecular Weight 467.880
Density 1.6±0.1 g/cm3 Boiling Point 783.3±60.0 °C at 760 mmHg
Molecular Formula C19H18ClN3O7S Melting Point N/A
MSDS N/A Flash Point 427.5±32.9 °C

 Names

Name (2S,5R,6R)-6-({[3-(2-Chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4,4-dioxide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.6±0.1 g/cm3
Boiling Point 783.3±60.0 °C at 760 mmHg
Molecular Formula C19H18ClN3O7S
Molecular Weight 467.880
Flash Point 427.5±32.9 °C
Exact Mass 467.055389
LogP 0.55
Vapour Pressure 0.0±2.8 mmHg at 25°C
Index of Refraction 1.676
InChIKey NVNVYZJTNPZRPA-JKIFEVAISA-N
SMILES Cc1onc(-c2ccccc2Cl)c1C(=O)NC1C(=O)N2C(C(=O)O)C(C)(C)S(=O)(=O)C12

 Synonyms

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-, 4,4-dioxide, (2S,5R,6R)-
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-, 4,4-dioxide, [2S-(2α,5α,6β)]-
(2S,5R,6R)-6-({[3-(2-Chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4,4-dioxide
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