D-Alanine, 3-sulfino-

Base Information

• Chemical Name: D-Alanine, 3-sulfino-
• CAS No.: 35554-99-5
• Molecular Formula: C3H7NO4S
• Molecular Weight: 153.15700
• UNII: A6YN9EAW93
• DSSTox Substance ID: DTXSID801315480
• Nikkaji Number: J870.417A
• ChEMBL ID: CHEMBL1316081
• Mol file: 35554-99-5.mol

Synonyms:D-Alanine, 3-sulfino-;D-Cysteine sulfinate;Cysteinesulfinate, D-;Cysteinesulfinic acid, D-;A6YN9EAW93;Cysteinesulfinic acid, (-)-;Alanine, beta-sulfino-;35554-99-5;UNII-A6YN9EAW93;Lopac-C-4418;3-Sulfinoalanine #;D-Cysteine sulphinate;3-Sulfino-D-alanine;CHEMBL1316081;SCHEMBL15264082;ALANINE, .BETA.-SULFINO-;DTXSID801315480;NCGC00015239-01

Chemical Property of D-Alanine, 3-sulfino-

Chemical Property:

• Boiling Point: 492.8±55.0 °C(Predicted)
• PSA: 119.83000
• Density: 1.828±0.06 g/cm3(Predicted)
• LogP: 0.18600
• XLogP3: -4.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 153.00957888
• Heavy Atom Count: 9
• Complexity: 136

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(C(=O)O)N)S(=O)O
• Isomeric SMILES: C([C@H](C(=O)O)N)S(=O)O

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