6-Aminopenicillanic acid

About This Item

Molecular Formula	C₈H₁₂N₂O₃S
CAS Number	551-16-6

FC-0145213

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Properties

Chemical Identifiers

IUPAC Name	(2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SMILES	CC1(C(N2C(S1)C(C2=O)N)C(=O)O)C
InChI Key	NGHVIOIJCVXTGV-ALEPSDHESA-N
InChI	InChI=1S/C8H12N2O3S/c1-8(2)4(7(12)13)10-5(11)3(9)6(10)14-8/h3-4,6H,9H2,1-2H3,(H,12,13)/t3-,4+,6-/m1/s1

Physical Properties

Boiling Point	460.2±45.0 °C at 760 mmHg
Melting Point	198-200 °C (dec.)(lit.)
Flash Point	232.1±28.7 °C
Density	1.5±0.1 g/cm3

Safety Information

Hazard Class

Danger

Flash Point

232.1±28.7 °C

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.