(±)-p,α-Dimethylbenzylalkohol

p,alpha-DIMETHYLBENZYL ALCOHOL

HCID 10817CAS 536-50-5
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Grundinformationen

Standard-SMILES
Cc1ccc(C(C)O)cc1
InChIKey
JESIHYIJKKUWIS-UHFFFAOYSA-N
Summenformel
C9H12O
Durchschnittliche Molmasse
136,19 g/mol
Monoisotopische Masse
136,088815

Überblick

1-(4-Methylphenyl)ethanol is a member of toluenes.

Namen und Bezeichner

Bevorzugter Name
p,alpha-DIMETHYLBENZYL ALCOHOL
IUPAC
1-(4-methylphenyl)ethanol
Lokaler Name
(±)-p,α-Dimethylbenzylalkohol
Englischer Name
(±)-p,alpha-dimethylbenzyl alcohol
Summenformel
C9H12O
Molmasse
136.19098

Namen und Synonyme

1-(4-Methylphenyl)ethanol536-50-51-(p-Tolyl)ethanolBilagenNorbilanTomobil1-p-TolylethanolGalinexMethyl-p-tolylcarbinolp-Tolylmethylcarbinol1-(P-METHYLPHENYL)ETHANOL1-(4-Tolyl)ethanol
Weitere Namen anzeigen
(±)-α,4-Dimethylbenzenemethanolrac-(R*)-1-(4-Methylphenyl)ethanol(1)-p,alpha-Dimethylbenzyl alcoholrac-(R*)-α,4-Dimethylbenzyl alcoholrac-(1R*)-1-(4-Methylphenyl)ethanol
1-(4-methylphenyl)ethan-1-ol1-p-Tolyl-1-ethanolp,alpha-Dimethylbenzyl alcoholhawthorn carbinolalpha,4-Dimethylbenzenemethanol4-TolylmethylcarbinolEthanol, 1-(p-tolyl)-Benzenemethanol, .alpha.,4-dimethyl-

Datenbank-Bezeichner

CAS
536-50-5、5788-09-0
PubChem CID
10817
DTXSID
DTXSID00862145
ChEBI
CHEBI:191886
UNII
MUV6GV10SL
EC Number
208-637-8、227-320-5
Nikkaji
J36.098H

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,8
Polarare Oberfläche (TPSA)
20,2 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
1
Schwere Atome
10

Experimentelle und physikochemische Eigenschaften

PolymersOther Classes -> Alcohols and Polyols, Other
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.980-0.990
Flavoring AgentsEU Flavoring substances
Solubility · 2 Einträge

insoluble in water; soluble in organic solvents, oils

miscible at room temperature (in ethanol)

Boiling Point218-219 °C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 100% (193 of 193) of all reports.

Not Classified

Aggregated GHS information provided per 193 reports by companies from 1 notifications to the ECHA C&L Inventory.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: Benzenemethanol, .alpha.,4-dimethyl-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

Benzenemethanol, .alpha.,4-dimethyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummarySafe when used as a flavoring agent in food; [JECFA] Not considered hazardous by GHS classifications; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesNot Classified

Chemie und Industrie

Pharmakologische Informationen

Cellular LocationsCytoplasm

Verwendung und Herstellung

UsesComponent of the essential oil from some plants in the ginger family; [Merck Index] Used as a flavoring agent; [FDA]
Use Classification · 2 Einträge

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

General Manufacturing InformationBenzenemethanol, .alpha.,4-dimethyl-: ACTIVE

Anbieter50 Anbieter

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