Primuline

Base Information

• Chemical Name: Primuline
• CAS No.: 10360-31-3
• Deprecated CAS: 33940-15-7,1189733-10-5,1189733-10-5
• Molecular Formula: C21H15 N3 O3 S3 . Na
• Molecular Weight: 475.548
• European Community (EC) Number: 233-781-3
• DSSTox Substance ID: DTXSID1065051
• Nikkaji Number: J236.787D
• Wikipedia: Primuline
• Wikidata: Q7243701
• ChEMBL ID: CHEMBL3974381
• Mol file: 10360-31-3.mol

Synonyms:C.I. Direct Yellow 59;primulin fluorochrome;primuline

Chemical Property of Primuline

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 171.03000
• Density: 1.537g/cm³
• LogP: 7.03930
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 475.00949912
• Heavy Atom Count: 31
• Complexity: 731

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(S4)C5=CC=C(C=C5)N)S(=O)(=O)[O-].[Na+]

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