2,6-Dimethoxy-p-kresol

4-Methyl-2,6-dimethoxyphenol

HCID 240925CAS 6638-05-7
TeilstruktursucheÄhnliche Strukturen suchen

Grundinformationen

Standard-SMILES
COc1cc(C)cc(OC)c1O
InChIKey
ZFBNNSOJNZBLLS-UHFFFAOYSA-N
Summenformel
C9H12O3
Durchschnittliche Molmasse
168,19 g/mol
Monoisotopische Masse
168,07864424

Namen und Bezeichner

Bevorzugter Name
4-Methyl-2,6-dimethoxyphenol
IUPAC
2,6-dimethoxy-4-methylphenol
Lokaler Name
2,6-Dimethoxy-p-kresol
Englischer Name
2,6-DIMETHOXY-4-METHYLPHENOL
Summenformel
C9H12O3
Molmasse
168.19

Namen und Synonyme

2,6-Dimethoxy-4-methylphenol6638-05-74-Methyl-2,6-dimethoxyphenol4-MethylsyringolPhenol, 2,6-dimethoxy-4-methyl-2,6-Dimethoxy-p-cresol3,5-Dimethoxy-4-hydroxytoluenep-Cresol, 2,6-dimethoxy-4-Hydroxy-3,5-dimethoxytolueneFJJ5MYE75WFEMA No. 37042,6-DIMETHOXY-4-CRESOL
Weitere Namen anzeigen
FEMA 3704Syringol, 4-methyl2,6-dimethoxy-4-methyl-phenoMethylsyringol, 10 mM in DMSO
DTXSID10216599EINECS 229-641-6UNII-FJJ5MYE75WNSC-479011-Methyl-3,5-dimethoxy-4-hydroxybenzeneNSC 479014-METHYL-2,6-DIMETHOXYPHENOL [FHFI]RefChem:99717

Datenbank-Bezeichner

CAS
6638-05-7
PubChem CID
240925
DTXSID
DTXSID10216599
ChEMBL
CHEMBL205268
ChEBI
CHEBI:172423
UNII
FJJ5MYE75W
EC Number
229-641-6
Nikkaji
J27.322H

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,9
Polarare Oberfläche (TPSA)
38,7 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
2
Schwere Atome
12

Experimentelle und physikochemische Eigenschaften

Solubility · 2 Einträge

insoluble in water; soluble in fat

moderately soluble (in ethanol)

Boiling Point · 2 Einträge

145.00 to 146.00 °C. @ 14.00 mm Hg

145-146 °C (12 mm Hg)

Melting Point36 °C
Physical Description · 2 Einträge

Solid

Pale yellow semi-solid, phenolic medicinal odour

Kovats Retention Index · 3 Einträge

1473；1403；1473；1404.4

1447.5；1447.1；1451.3；1442.9

2350；2349；2332；2316.5；2343.9；2359.2

Physikochemische Eigenschaften

Schmelzpunkt
37 · 37-42 °C(lit.)
Siedepunkt
145 · 145-146 °C14 mm Hg(lit.)
Dichte
1.105 · 1.105±0.06 g/cm3(Predicted)
FEMA
3704 · 3704 | 4-METHYL-2,6-DIMETHOXYPHENOL
Flammpunkt
230 °F · >230 °F
storage temp.
2 · Inert atmosphere,2-8°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (78.8%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (99.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 212 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: Phenol, 2,6-dimethoxy-4-methyl-

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

Phenol, 2,6-dimethoxy-4-methyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 4 (78.8%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (99.5%)

Regulatorische Informationen

Regulatory Information · 3 Einträge

Chemical: Phenol, 2,6-dimethoxy-4-methyl-

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

Phenol, 2,6-dimethoxy-4-methyl-: Does not have an individual approval but may be used under an appropriate group standard

Sicherheitsdaten

wgk
3
hs_code
29095000
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36
Speicherklasse
11 - Combustible Solids

Chemie und Industrie

Pharmakologische Informationen

Cellular LocationsCytoplasm；Extracellular

Verwendung und Herstellung

Use Classification · 4 Einträge

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Anwendungen

OccurrenceReported found in dried bonito, smoked pork belly, smoked sausage, natural smoke flavor, cured and uncured pork, beer, cuttlefish and smoked fish.

VerwendenUsed as a flavor and fragrance agents.

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]

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