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49621-03-6

49621-03-6 structural image
Product Name: S-ALLYL-L-CYSTEINE
Formula: C6H11NO2S
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Boiling Point 300.00 to 301.00 °C. @ 760.00 mm Hg
Melting Point 218 °C
Solubility slightly
LogP 1.310

COMPUTED DESCRIPTORS

Molecular Weight 161.22 g/mol
XLogP3 -2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 161.05104977 g/mol
Monoisotopic Mass 161.05104977 g/mol
Topological Polar Surface Area 88.6 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 127
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes