2',4'-Dihydroxy-3'-propylacetophenone

HCID 2775198CAS 40786-69-4
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Grundinformationen

Standard-SMILES
CCCc1c(O)ccc(C(C)=O)c1O
InChIKey
QGGRBWUQXAFYEC-UHFFFAOYSA-N
Summenformel
C11H14O3
Durchschnittliche Molmasse
194,23 g/mol
Monoisotopische Masse
194,09429431

Namen und Bezeichner

Bevorzugter Name
2',4'-Dihydroxy-3'-propylacetophenone
IUPAC
1-(2,4-dihydroxy-3-propylphenyl)ethanone
Englischer Name
2',4'-Dihydroxy-3'-propylacetophenone
Summenformel
C11H14O3
Molmasse
194.23

Namen und Synonyme

2',4'-DIHYDROXY-3'-PROPYLACETOPHENONERefChem:439424627-597-640786-69-41-(2,4-dihydroxy-3-propylphenyl)ethanone1-(2,4-Dihydroxy-3-propylphenyl)ethan-1-oneMFCD000686162,4-Dihydroxy-3-PropylacetophenoneEthanone, 1-(2,4-dihydroxy-3-propylphenyl)-1-[2,4-dihydroxy-3-propylphenyl)ethanoneEthanone,1-(2,4-dihydroxy-3-propylphenyl)-1-(2,4-dihydroxy-3-propyl-phenyl)ethanone
Weitere Namen anzeigen
4-dihydroxy-3-propylphenyl)-Dihydroxy-3'-Propylacetophenone2',4'-Dihydroxy-3'-pyopylacetophene(2,4-Dihydroxy-3-n-propylphenyl)ethanone2,2-dihydroxy-1-(3-propylphenyl)ethanone2',4'-DIHYDROXY-3'-PROPYLACETOPHENONE, 9 9%
SCHEMBL480388SCHEMBL6932259SCHEMBL30736074DTXSID80379448QGGRBWUQXAFYEC-UHFFFAOYSA-N2',4'-dihydroxy-3'-propyl aceCS-M09272,4-di-hydroxy-3-propylacetophenone

Datenbank-Bezeichner

CAS
40786-69-4
PubChem CID
2775198
DTXSID
DTXSID80379448
EC Number
627-597-6
Nikkaji
J282.497C

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,8
Polarare Oberfläche (TPSA)
57,5 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
3
Schwere Atome
14

Physikochemische Eigenschaften

Schmelzpunkt
124 · 124-127 °C (lit.)
Siedepunkt
361 · 361.0±12.0 °C(Predicted)
Dichte
1.162 · 1.162±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
Löslichkeit
Chloroform (Slightly), Methanol (Slightly)
Aggregatzustand
Solid

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheitsdaten

wgk
3
hs_code
2914500090
risk_code
36/37/38
hazard_code
Xi
hazard_note
Irritant
safety_code
26-36

Chemie und Industrie

Anwendungen

Verwenden1-(2,4-Dihydroxy-3-propylphenyl)ethanone is a reactant used in the synthesis of 2’-hydroxychalcones which affect cell growth inihibition , initiates apoptosis in human tumor cell lines.

Darstellung

synthetischePreparation by reaction of acetonitrile on 2-propylresorcinol (Hoesch reaction) (86%).

Anbieter50 Anbieter

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Changzhou Anxuan Chemical Co., Ltd+86-0519-89882563 +86-18961279162 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]

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