4-Sec-butyl-2-(1-phenylethyl)phenol

Base Information

• Chemical Name: 4-Sec-butyl-2-(1-phenylethyl)phenol
• CAS No.: 2622-83-5
• Molecular Formula: C18H22O
• Molecular Weight: 254.37
• Hs Code.: 2907199090
• European Community (EC) Number: 220-075-5
• NSC Number: 97296
• DSSTox Substance ID: DTXSID50949091
• Nikkaji Number: J192.131B
• Mol file: 2622-83-5.mol

Synonyms:2622-83-5;4-Sec-butyl-2-(1-phenylethyl)phenol;4-butan-2-yl-2-(1-phenylethyl)phenol;4-Sec-butyl-2-(a-methylbenzyl)phenol;Phenol, 4-(1-methylpropyl)-2-(1-phenylethyl)-;4-sec-Butyl-2-(alpha-methylbenzyl)phenol;4-(1-Methylpropyl)-2-(1-phenylethyl)phenol;Phenol, 4-sec-butyl-2-(.alpha.-methylbenzyl)-;EINECS 220-075-5;4-Sec-Butyl-2-(A-Methylbenzyl) phenol;4-(Butan-2-yl)-2-(1-phenylethyl)phenol;4-sec-Butyl-2-(.alpha.-methylbenzyl)phenol;4-sec-Butyl-2-(.alpha.-methylbenzyl)alcohol;NSC97296;PROPYL4-NITROBENZOATE;SCHEMBL7890335;DTXSID50949091;MFCD00038321;NSC 97296;NSC-97296;AKOS022507254;4-s-butyl-2(alpha-methylbenzyl) phenol;4-sec-Butyl-2-(1-phenylethyl)phenol #;FT-0619462;PHENOL,4-(1-METHYLPROPYL)-2-(1-PHENYLETHYL)-

Chemical Property of 4-Sec-butyl-2-(1-phenylethyl)phenol

Chemical Property:

• Vapor Pressure: 1.24E-05mmHg at 25°C
• Refractive Index: 1.557
• Boiling Point: 358.3 °C at 760 mmHg
• PKA: 10.18±0.50(Predicted)
• Flash Point: 167.3 °C
• PSA: 20.23000
• Density: 1.013 g/cm³
• LogP: 5.05750
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 254.167065321
• Heavy Atom Count: 19
• Complexity: 256

Purity/Quality:

99% ^*data from raw suppliers

4-SEC-BUTYL-2-(A-METHYLBENZYL) PHENOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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