4-Sulfoxyphenylacetyl dehydroalanine

Base Information

• Chemical Name: 4-Sulfoxyphenylacetyl dehydroalanine
• CAS No.: 138748-39-7
• Molecular Formula: C11H11 N O7 S
• Molecular Weight: 301.27254
• DSSTox Substance ID: DTXSID10160765
• Wikidata: Q83029103
• Mol file: 138748-39-7.mol

Synonyms:4-sulfoxyphenylacetyl dehydroalanine;AD 19;AD-19;parasulfoxyphenyl-acetyl dehydroalanine

Chemical Property of 4-Sulfoxyphenylacetyl dehydroalanine

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 141.87000
• Density: 1.558g/cm³
• LogP: 2.04630
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 301.02562286
• Heavy Atom Count: 20
• Complexity: 485

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=C(C(=O)O)NC(=O)CC1=CC=C(C=C1)OS(=O)(=O)O

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