Chemical Properties of Phenol, 4-(1,1-dimethylethyl)-, phosphate (3:1) (CAS 78-33-1)

Phenol, 4-(1,1-dimethylethyl)-, phosphate (3:1)

InChI
InChI=1S/C30H39O4P/c1-28(2,3)22-10-16-25(17-11-22)32-35(31,33-26-18-12-23(13-19-26)29(4,5)6)34-27-20-14-24(15-21-27)30(7,8)9/h10-21H,1-9H3
InChI Key
LORSVOJSXMHDHF-UHFFFAOYSA-N
Formula
C30H39O4P
SMILES
CC(C)(C)c1ccc(OP(=O)(Oc2ccc(C(C)(C)C)cc2)Oc2ccc(C(C)(C)C)cc2)cc1
Molecular Weight1
494.60
CAS
78-33-1
Other Names
  • p-tert-Butylphenol, phosphate (3:1)
  • Phenol, p-tert-butyl-, phosphate (3:1)
  • Tris(p-tert-butylphenyl) phosphate
  • Tris(4-tert-butylphenyl) phosphate
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Physical Properties

Property Value Unit Source
ω 1.0030 Relay (1.0) Calculated Property
ΔfG° -53.20 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -685.81 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 123.35 kJ/mol Relay (1.0) Calculated Property
IE 8.26 eV Relay (1.0) Calculated Property
log10WS -9.46 Relay (1.0) Calculated Property
logPoct/wat 9.224 Crippen Calculated Property
McVol 406.220 ml/mol McGowan Calculated Property
Pc 441.86 kPa Relay (1.0-beta) Calculated Property
Tboil 721.05 K Relay (1.0) Calculated Property
Tc 1040.96 K Relay (1.0) Calculated Property
Tfus 363.33 K Relay (1.0) Calculated Property
Vc 1.541 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Bis(4-tert-butylphenyl) phenyl phosphate. O-(4-tert-butylphenyl) 0-phenyl phosphorochloridate. 4-([Bis(4-tert-butylphenoxy)phosphoryl]oxy)-1,1'-biphenyl. Tris[4-(1,1,3,3-tetramethylbutyl)phenyl] phosphate. 4-Tert-butylphenyl bis(2-methylphenyl) phosphate. Tris(2,4-di-tert-butylphenyl) phosphate. Bis(4-tert-butyl-2-methylphenyl) phenyl phosphate. P-sec-butyl phenyl phosphate. [1,1'-Biphenyl]-2-yl 4-tert-butylphenyl phenyl phosphate. Di[1,1'-biphenyl]-2-yl 4-tert-butylphenyl phosphate. Phenol, 2,4-bis(1,1-dimethylethyl)-, phosphite (3:1). Phenol, p-tert-butyl-. Benzene, 1-(1,1-dimethylethyl)-4-methoxy-. Trimethyl(4-tert-butylphenoxy)silane. Benzene, 1-(1,1-dimethylethyl)-4-ethoxy-.

Find more compounds similar to Phenol, 4-(1,1-dimethylethyl)-, phosphate (3:1).

Sources

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