Grundinformationen
- Standard-SMILES
Cc1cc(Cc2cc(C)cc(C3(C)CCCCC3)c2O)c(O)c(C2(C)CCCCC2)c1- InChIKey
PHXLONCQBNATSL-UHFFFAOYSA-N- Summenformel
- C29H40O2
- Durchschnittliche Molmasse
- 420,6 g/mol
- Monoisotopische Masse
- 420,30283052
Namen und Bezeichner
- Bevorzugter Name
- 2,2'-Methylenebis(6-(1-methylcyclohexyl)-p-cresol)
- IUPAC
- 2-[[2-hydroxy-5-methyl-3-(1-methylcyclohexyl)phenyl]methyl]-4-methyl-6-(1-methylcyclohexyl)phenol
- Lokaler Name
- 2,2'-Methylenbis[6-(1-methylcyclohexyl)-p-kresol]
- Englischer Name
- BIS[2-HYDROXY-5-METHYL-3-(1-METHYLCYCLOHEXYL)PHENYL]METHANE
- Summenformel
- C29H40O2
- Molmasse
- 420.63
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
77-62-3- PubChem CID
- 6486
- DTXSID
DTXSID3052517- UNII
- 7TIR91VDI9
- EC Number
- 201-044-5
- Nikkaji
- J192.562H
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 10
- Polarare Oberfläche (TPSA)
- 40,5 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 31
- Formalladung
- 0
- Komplexität
- 523
Experimentelle und physikochemische Eigenschaften
Food Contact Substances
FCS -> FDA Cumulative Estimated Daily Intake (CEDI)
FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physikochemische Eigenschaften
- Schmelzpunkt
- 135 °C · 135°C
- Siedepunkt
- 526.9 · 526.9±50.0 °C(Predicted)
- Dichte
- 1.058 · 1.058±0.06 g/cm3(Predicted)
- pka
- 10.14 · 10.14±0.50(Predicted)
- Aggregatzustand
- powder to crystal
- Farbe
- White to Light yellow to Light orange
- BRN
- 2313064 · 2313064
- EPA chemische Informationen
- 2 · 2,2'-Methylenebis[6-(1-methylcyclohexyl)-p-cresol] (77-62-3)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
H413 (99.5%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 184 reports by companies from 2 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: Phenol, 2,2â²-methylenebis[4-methyl-6-(1-methylcyclohexyl)-
Status: Active Update: 06-02-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22349
Phenol, 2,2'-methylenebis[4-methyl-6-(1-methylcyclohexyl)-: Non hazardous
Toxikologische Informationen
Sicherheitsdaten
- tsca
- TSCA listed
- hs_code
- 2907.19.8000
- risk_code
- 36/37/38
- safety_code
- 26-36/37/39
- Giftige Stoffe Daten
- 77-62-3(Hazardous Substances Data)
Chemie und Industrie
Verwendung und Herstellung
Uses
Used as antioxidant; [HSDB] Used as a polymer stabilizer; [MSDSonline]
ANTIOXIDANT
General Manufacturing Information
Phenol, 2,2'-methylenebis[4-methyl-6-(1-methylcyclohexyl)-: ACTIVE
ANTIFUNGAL ACTIVITY OF SERIES OF ALKYL & ALKYLARYL PHENOLS WERE TESTED IN VITRO AGAINST 9 STRAINS OF PATHOGENIC FUNGI, ASPERGILLUS, MICROSPORUM, TRICHOPHYTON, CANDIDA. 2 COMPD SHOWED MUTAGENIC ACTIVITY IN SALMONELLA.
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