2,6-CRESOTIC ACID, 3-tert-PENTYL-

Base Information

• Chemical Name: 2,6-CRESOTIC ACID, 3-tert-PENTYL-
• CAS No.: 20717-19-5
• Molecular Formula: C13H18 O3
• Molecular Weight: 222.2802
• DSSTox Substance ID: DTXSID40174779
• Wikidata: Q83044919
• Mol file: 20717-19-5.mol

Synonyms:BRN 2845570;2,6-CRESOTIC ACID, 3-tert-PENTYL-;3-tert-Pentyl-2,6-cresotic acid;2-Methyl-5-tert-amylsalicylic acid;20717-19-5;SCHEMBL9249361;DTXSID40174779;LS-55466

Chemical Property of 2,6-CRESOTIC ACID, 3-tert-PENTYL-

Chemical Property:

• Vapor Pressure: 5.02E-05mmHg at 25°C
• Boiling Point: 334.5°C at 760 mmHg
• Flash Point: 170.3°C
• Density: 1.112g/cm³
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 222.125594432
• Heavy Atom Count: 16
• Complexity: 260

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)(C)C1=C(C(=C(C=C1)C)C(=O)O)O