Sulforhodamine B 2-acid fluoride

Base Information

• Chemical Name: Sulforhodamine B 2-acid fluoride
• CAS No.: 98806-82-7
• Molecular Formula: C27H29FN2O6S2
• Molecular Weight: 560.66
• European Community (EC) Number: 622-779-1
• DSSTox Substance ID: DTXSID30401501
• Wikidata: Q82204643
• Mol file: 98806-82-7.mol

Synonyms:Sulforhodamine B 2-acid fluoride;98806-82-7;4-[3-(diethylamino)-6-diethylazaniumylidenexanthen-9-yl]-3-fluorosulfonylbenzenesulfonate;4-[6-(Diethylamino)-3-(diethyliminio)-3H-xanthen-9-yl]-3-(fluorosulfonyl)benzenesulfonate;DTXSID30401501

Chemical Property of Sulforhodamine B 2-acid fluoride

Chemical Property:

• PSA: 145.44000
• LogP: 7.51490
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 560.14510716
• Heavy Atom Count: 38
• Complexity: 1170

Purity/Quality:

98%Min ^*data from raw suppliers

SulforhodamineB2-AcidFluoride ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=C(C=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)F
• Uses: Sulforhodamine B 2-Acid Fluoride (cas# 98806-82-7) is a compound useful in organic synthesis.

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