4,4'-(1-(4-(1-(4-Hydroxyphenyl)-1-methylethyl)phenyl)ethylidene)diphenol

HCID 634278CAS 110726-28-8

Grundinformationen

Standard-SMILES
CC(C)(c1ccc(O)cc1)c1ccc(C(C)(c2ccc(O)cc2)c2ccc(O)cc2)cc1
InChIKey
WXYSZTISEJBRHW-UHFFFAOYSA-N
Summenformel
C29H28O3
Durchschnittliche Molmasse
424,5 g/mol
Monoisotopische Masse
424,20384476

Namen und Bezeichner

Bevorzugter Name
4,4'-(1-(4-(1-(4-Hydroxyphenyl)-1-methylethyl)phenyl)ethylidene)diphenol
IUPAC
4-[2-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]propan-2-yl]phenol
Englischer Name
alpha,alpha,alpha'-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene
Summenformel
C29H28O3
Molmasse
424.53

Namen und Synonyme

Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis-DTXSID3073052EC 425-600-3Phenol, 4,4'-(1-(4-(1-(4-hydroxyphenyl)-1-methylethyl)phenyl)ethylidene)bis-4,4'-(1-(4-(1-(4-Hydroxyphenyl)-1-methylethyl)phenyl)ethylidene)diphenol4,4'-(1-{4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl}ethylidene)diphenol4,4'-(1-(4-(1-(4-hydroxyphenyl)-1-methylethyl)phenyl)ethylidene)bisphenol4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bisphenolRefChem:506440DTXCID5033179425-600-3638-739-1
Weitere Namen anzeigen
Trisphenol PATrishydroxyphenylethylisopropylbezeneTriphenol ATRIS-PA (PHENOL)ethane-1,1-diyl)4,4'-(1-(4-(2-(4-Hydroxyphenyl)a,a,a'-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzeneα,α,α'-Tris(4-hydroxyphenyl)-1- ethyl-4-isopropylbezene
110726-28-84,4'-(1-(4-(2-(4-hydroxyphenyl)propan-2-yl)phenyl)ethane-1,1-diyl)diphenolalpha,alpha,alpha'-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene4-[2-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]propan-2-yl]phenolMFCD00191685C29H28O34-(2-{4-[1,1-BIS(4-HYDROXYPHENYL)ETHYL]PHENYL}PROPAN-2-YL)PHENOL4-[1-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]-1-methyl-ethyl]phenol

Datenbank-Bezeichner

CAS
110726-28-8
PubChem CID
634278
DTXSID
DTXSID3073052
ChEMBL
CHEMBL455575
EC Number
425-600-3、638-739-1
Nikkaji
J157.826J

Eigenschaften

Berechnete Struktureigenschaften

XLogP
6,9
Polarare Oberfläche (TPSA)
60,7 Ų
H-Brücken-Donoren
3
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
5
Schwere Atome
32

Experimentelle und physikochemische Eigenschaften

Endocrine DisruptorsPotential endocrine disrupting compound
Physical DescriptionWet Solid

Physikochemische Eigenschaften

Schmelzpunkt
225 °C · 225°C
Siedepunkt
623.1 · 623.1±50.0 °C(Predicted)
Dichte
1.186 · 1.186±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
Löslichkeit
soluble in Methanol
Aggregatzustand
powder to crystal

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

H413: 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)

H413 (100%): 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 18 reports by companies from 2 notifications to the ECHA C&L Inventory.

Warning

Gefahrenhinweise

Regulatory Information · 3 Einträge

Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis- 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)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 14-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33600

Hazard Classes and Categories · 4 Einträge

Aquatic Chronic 4 (100%)

Skin Irrit. 2 (50%)

Hazardous to the aquatic environment (chronic) - category 4

Aquatic Chronic 4

Sicherheitsdaten

tsca
TSCA listed
hs_code
2907.29.2500
risk_code
36/37/38
safety_code
26-36/37/39

Chemie und Industrie

Verwendung und Herstellung

U.S. Production2023: <50,000 lb
Consumer UsesSolvent
Industry UsesPhotosensitizers
General Manufacturing Information · 2 Einträge

All Other Chemical Product and Preparation Manufacturing

Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis-: ACTIVE

Anwendungen

Verwendenα,α,α''-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene is a useful reactant in the synthesis of single-walled carbon nanotubes (SWNTs) through irradation with an IR laser.

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4,4'-(1-(4-(1-(4-Hydroxyphenyl)-1-methylethyl)phenyl)ethylidene)diphenol (HCID 634278)|Huagongshe