120-95-6

Name 2,4-Di-tert-pentylphenol
CAS 120-95-6
EINECS(EC#) 204-439-0
Molecular Formula C16H26O
MDL Number MFCD00041929
Molecular Weight 234.38
MOL File 120-95-6.mol

Chemical Properties

Appearance clear yellow liquid after melting
Melting point  25 °C (lit.)
Boiling point  169-170 °C/22 mmHg (lit.)
density  0.930 g/mL at 25 °C(lit.)
refractive index  1.506-1.508
Fp  >230 °F
storage temp.  2-8°C
form  powder to lump to clear liquid
pka 11.00±0.31(Predicted)
color  White or Colorless to Almost white or Almost colorless
Water Solubility  3mg/L at 21℃
InChI InChI=1S/C16H26O/c1-7-15(3,4)12-9-10-14(17)13(11-12)16(5,6)8-2/h9-11,17H,7-8H2,1-6H3
InChIKey WMVJWKURWRGJCI-UHFFFAOYSA-N
SMILES C1(O)=CC=C(C(C)(C)CC)C=C1C(C)(C)CC
LogP 6.3 at 22℃
CAS DataBase Reference 120-95-6(CAS DataBase Reference)
NIST Chemistry Reference 2,4-Di-tert-amyl phenol(120-95-6)
EPA Substance Registry System 120-95-6(EPA Substance)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)Health Hazard (GHS08)Environment (GHS09)
GHS07,GHS08,GHS09
Signal word  Warning
Hazard statements  H371-H410-H302-H319
Precautionary statements  P260-P264-P270-P273-P280-P301+P312+P330-P305+P351+P338+P337+P313-P308+P311-P391-P405-P501-P305+P351+P338
Hazard Codes  Xn
Risk Statements 
R22:Harmful if swallowed.
R36:Irritating to the eyes.
R36/38:Irritating to eyes and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
RIDADR  3077
WGK Germany  2
RTECS  SL3500000
TSCA  TSCA listed
REACH Registrations Active
HazardClass  9
PackingGroup  III
HS Code  29071990
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2
Safety Profile
Poison by ingestion. An eye irritant. When heated to decomposition it emits acrid smoke and irritating fumes. See also PHENOL.
Hazardous Substances Data 120-95-6(Hazardous Substances Data)

Hazard Information

Material Safety Data Sheet(MSDS)

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