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(E)-N~5~-(Amino{[(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)sulfonyl]amino}methylene)-D-ornithine(CAS: 200116-81-0)

(E)-N~5~-(Amino{[(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)sulfonyl]amino}methylene)-D-ornithine
CAS Number

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Basic Information

Molecular Formula
C19H30N4O5S
Molecular Weight
426.54 g/mol

Chemical Identifiers

SMILES
CC1=C(C(=C(C2=C1OC(C2)(C)C)C)S(=O)(=O)NC(=NCCCC(C(=O)O)N)N)C
InChIKey
GVIXTVCDNCXXSH-CQSZACIVSA-N

Database References

MDL Number
MFCD00236798

FAQ

The compound is a solid with a crystalline form. It has a molecular weight of approximately 611.68 g/mol. Solubility in water is low, approximately 0.1 g/L at 25°C. Chemically, it is stable under normal conditions but exhibits limited reactivity with strong bases or reducing agents.
The compound is synthesized through a multi-step process involving the condensation of D-ornithine with a sulfonylated benzofuran derivative. Commonly, the synthesis involves the use of a catalytic amount of a strong acid like trifluoroacetic acid, and the process typically yields a 70% to 80% isolated purity.
This compound is used in pharmaceutical applications for its bioactive properties. It is also utilized in the development of sensors and as a precursor in the synthesis of certain semiconducting materials.
When handling this compound, wear appropriate personal protective equipment (PPE) including gloves and safety glasses. Store in a cool, dry place away from strong acids and bases. Use in a fume hood to avoid inhalation. In case of spill, neutralize with a suitable base and dispose of according to local regulations. Refer to the Safety Data Sheet (SDS) for detailed handling instructions.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures