CAS
925-45-1 Purity
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925-45-1 Purity
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N-(3,5-Bis-(trifluoromethyl)phenyl)4-carboxybenzenesulfonamide
CAS
925459-49-0
Catalog Number
ACM925459490
Category
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- Synthetic Use
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What is the molecular formula of the compound N-(3,5-Bis-(trifluoromethyl)phenyl)4-carboxybenzenesulfonamide?
The molecular formula is C15H9F6NO4S.
What is the molecular weight of the compound?
The molecular weight is 413.3 g/mol.
When was this compound created in PubChem?
It was created on September 25, 2009.
What is the IUPAC name of the compound?
The IUPAC name is 4-[[3,5-bis(trifluoromethyl)phenyl]sulfamoyl]benzoic acid.
What is the InChI of the compound?
The InChI is InChI=1S/C15H9F6NO4S/c16-14(17,18)9-5-10(15(19,20)21)7-11(6-9)22-27(25,26)12-3-1-8(2-4-12)13(23)24/h1-7,22H,(H,23,24).
What is the InChIKey of the compound?
The InChIKey is GHCRIIZVQKFNLE-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES is C1=CC(=CC=C1C(=O)O)S(=O)(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 3.7.
How many hydrogen bond acceptors does the compound have?
It has 11 hydrogen bond acceptors.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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