Sulbactam
Properties
- Molecular formula
- C8H11NO5S
- Molar mass
- 233.24 g/mol
- Exact mass
- 233.0358 Da
- Melting point
- 148–151 °C
- logP
- -0.80Crippen estimate
- Polar surface area
- 91.8 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 1
- Stereocentres
- S, Rin SMILES atom order
Hazards
Danger
- H302 Harmful if swallowed51.2% of notifiers
- H317 May cause an allergic skin reaction47.5% of notifiers
- H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled47.5% of notifiers
Aggregated from 80 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P233, P260, P261, P264, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P321, P330, P333+P317, P342+P316, P362+P364, P403, P501
Identifiers
CAS number
68373-14-8SMILES
CC1(C)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=OInChIKey
FKENQMMABCRJMK-RITPCOANSA-NInChI
InChI=1S/C8H11NO5S/c1-8(2)6(7(11)12)9-4(10)3-5(9)15(8,13)14/h5-6H,3H2,1-2H3,(H,11,12)/t5-,6+/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-, 4,4-dioxide, (2S,5R)-
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-, 4,4-dioxide, (2S-cis)-
- CP 45899
- Penicillanic acid sulfone
- Penicillanic acid 1,1-dioxide
- Penicillanic acid dioxide
- Penicillanic acid S,S-dioxide
- Betamaze
Work with Sulbactam
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
Tazobactam89786-04-955 % similar
Sulbactam pivoxil69388-79-054 % similar
Sultamicillin76497-13-737 % similar
Tazobactam sodium89785-84-237 % similar
1-Methyl-5-oxopyrrolidine-3-carboxylic acid42346-68-933 % similar
Tazobactam diphenylmethyl ester89789-07-133 % similar
Sultamicillin tosylate83105-70-832 % similar
3-Carboxy-2,2,5,5-tetramethyl-1-pyrrolidinyloxy2154-68-931 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.