CAS Registry Number®
24158-88-1
CAS Name
(2S,5R)-6,6-Dibromo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Molecular Formula
C8H9Br2NO3S
Molecular Mass
359.04
Compound Properties
-
Melting Point (1)
142-145 °C
Source(s)
- (1) Zhang, H.-L.; Synthesis and Reactivity in Inorganic, Metal-Organic, and Nano-Metal Chemistry, (2012), 42(8), 1083-1086, CAplus
Other Names and Identifiers
InChI
InChI=1S/C8H9Br2NO3S/c1-7(2)3(4(12)13)11-5(14)8(9,10)6(11)15-7/h3,6H,1-2H3,(H,12,13)/t3-,6+/m0/s1
InChIKey
InChIKey=YLGIIVBDSLVWDR-BBIVZNJYSA-N
SMILES
C(O)(=O)[C@@H]1N2[C@@](C(Br)(Br)C2=O)(SC1(C)C)[H]
Canonical SMILES
O=C(O)C1N2C(=O)C(Br)(Br)C2SC1(C)C
Other Names for this Substance
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6,6-dibromo-3,3-dimethyl-7-oxo-, (2S,5R)-
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6,6-dibromo-3,3-dimethyl-7-oxo-, (2S–cis)-
- (2S,5R)-6,6-Dibromo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
- 6,6-Dibromopenicillanic acid
