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HCID 8455Erstellt: 26. Oktober 2026

2,4-Di-tert-pentylphenol

DTAP · 2,4-DI-TERT-AMYLPHENOL · Phenol, 2,4-bis(1,1-dimethylpropyl)- · Di-tert-amylphenol · 2,4-Di-t-pentyphenol · prodox156 · Prodox 156 · 2，4-di-t-amylphenol

https://huagongshe.com/de/chemical/8455

Molekülstruktur von 2,4-Di-tert-pentylphenol

Identifikatoren & physikalische Daten

CAS No.120-95-6
SummenformelC16H26O
Durchschnittliche Molmasse234,38 g/mol
Monoisotopische Masse234,19836545 g/mol
SMILESCCC(C)(C)c1ccc(O)c(C(C)(C)CC)c1
InChIKeyWMVJWKURWRGJCI-UHFFFAOYSA-N
PubChem CID8455
ChEMBLCHEMBL1890694
EC No.204-439-0
DTXSIDDTXSID9026974
Lokaler Name2,4-Di-tert-pentylphenol

Chemische & physikalische Eigenschaften

XLogP6
Polarare Oberfläche (TPSA)20,2
H-Brücken-Donoren1
H-Brücken-Akzeptoren1
Frei drehbare Bindungen4
Schwere Atome17
Formalladung0
Komplexität242
StoffklassenOther Classes -> Phenols
Dampfdruck0.0000841 [mmHg]
Food Contact SubstancesFCS -> FDA Cumulative Estimated Daily Intake (CEDI)
Physical DescriptionLiquidOther SolidSemi-solid that melts to colorless liquidmp = 25 deg C[MSDSonline]
Schmelzpunkt25 °C (lit.)
Siedepunkt169-170 °C/22 mmHg (lit.)
Dichte0.930 g/mL at 25 °C (lit.)
Brechungsindex1.506-1.508
Flammpunkt>230 °F
Lagerbedingungen2-8°C
Aggregatzustandpowder to lump to clear liquid
pKa (Säurekonstante)11.00±0.31(Predicted)
FarbeWhite or Colorless to Almost white or Almost colorless
Löslichkeit3mg/L at 21℃
InChIInChI=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
InChIKeyWMVJWKURWRGJCI-UHFFFAOYSA-N
SMILESC1(O)=CC=C(C(C)(C)CC)C=C1C(C)(C)CC
LogP (Verteilungskoeffizient)6.3 at 22℃
CAS Datenbank120-95-6(CAS DataBase Reference)
NIST chemische Informationen2,4-Di-tert-amyl phenol(120-95-6)
EPA chemische Informationen2,4-Di-tert-amylphenol (120-95-6)

Sicherheit & Vorschriften

GHS-EinstufungDangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P321, P330, P332+P317, P337+P317, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 91 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.H302: Harmful if swallowed [Warning Acute toxicity, oral]
Regulatorische InformationenChemical: Phenol, 2,4-bis(1,1-dimethylpropyl)-Regulation (EC) No 1935/2004 (amended)Phenol, 2,4-bis(1,1-dimethylpropyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 2,4-bis(1,1-dimethylpropyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 22-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/17246Phenol, 2,4-bis(1,1-dimethylpropyl)-: Does not have an individual approval but may be used under an appropriate group standard
GefahrenübersichtA moderate eye irritant when tested in rabbits[RTECS] An eye irritant[MSDSonline]
Hazard Classes and CategoriesAcute Tox. 4 (100%)Acute toxicity (Oral) - Category 4
Effluent ConcentrationsPOTENTIALLY TOXIC ORGANIC COMPOUNDS IN INDUSTRIAL WASTE WATERS & RIVER SYSTEMS, INCLUDING 2,4-DI-T-PENTYLPHENOL.
Wassergefährdungsklasse (WGK)2
TSCA-Inventar-StatusTSCA listed
UN-Transportnummer3077
Zollcode29071990
RTECS-Nr.SL3500000
R-Sätze (R)22-36-36/38
GefahrensymboleXn
Sicherheitshinweise (S)26-37/39
Gefahrenklasse9Acute Tox. 4 OralEye Irrit. 2
VerpackungsgruppeIII
Lagerklasse10 - Combustible liquids
Gefahrstoffdaten120-95-6(Hazardous Substances Data)

Anwendungen & Verwendung

Verwenden

UV Stabilizer Intermediate, Photographic Developers, Specialty Surfactants, Fuel Additive Intermediate