2-{4-[Ethyl(hexyl)amino]-2-hydroxybenzoyl}benzoic acid

Base Information

• Chemical Name: 2-{4-[Ethyl(hexyl)amino]-2-hydroxybenzoyl}benzoic acid
• CAS No.: 91458-45-6
• Molecular Formula: C22H27NO4
• Molecular Weight: 369.45400
• DSSTox Substance ID: DTXSID50600190
• Nikkaji Number: J73.122F
• Wikidata: Q82496155
• Mol file: 91458-45-6.mol

Synonyms:91458-45-6;SCHEMBL9628808;DTXSID50600190;2-{4-[ETHYL(HEXYL)AMINO]-2-HYDROXYBENZOYL}BENZOIC ACID

Chemical Property of 2-{4-[Ethyl(hexyl)amino]-2-hydroxybenzoyl}benzoic acid

Chemical Property:

• PSA: 77.84000
• LogP: 4.72800
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 10
• Exact Mass: 369.19400834
• Heavy Atom Count: 27
• Complexity: 481

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCN(CC)C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)O