2,6-Dichloro-4-hydroxybenzaldehyde

HCID 528382CAS 60964-09-2

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: O=Cc1c(Cl)cc(O)cc1Cl
InChIKey: WWFRBIPLCLSKNH-UHFFFAOYSA-N
Summenformel: C7H4Cl2O2
Durchschnittliche Molmasse: 191,01 g/mol
Monoisotopische Masse: 189,95883473

Namen und Bezeichner

Bevorzugter Name: 2,6-Dichloro-4-hydroxybenzaldehyde
IUPAC: 2,6-dichloro-4-hydroxybenzaldehyde
Englischer Name: 2,6-Dichloro-4-hydroxybenzaldehyde
Summenformel: C7H4Cl2O2
Molmasse: 191.01

Namen und Synonyme

2,6-dichloro-4-hydroxybenzaldehyde60964-09-2DTXSID10336009RefChem:248248DTXCID20287098WWFRBIPLCLSKNH-UHFFFAOYSA-N2,6-dichloro-4-hydroxy-benzaldehydeMFCD06797919SCHEMBL209239Benzaldehyde,2,6-dichloro-4-hydroxyAKOS015891439Benzaldehyde, 2,6-dichloro-4-hydroxy-

Weitere Namen anzeigen

3,7-Dichloroacetophenone2,6-DICHLORO-4-HYDROXYBENZALDEHYD2,6-Dichloro-3-hydroxy-benzaldehydetert-butyl 3-allyl-3-hydroxyazetidine-104-carboxylate

THIOPHENE,2-(BROMOMETHYL)-FT-0691471A8329732,6-dichloro-4-hydroxy benzaldehyde2,6-Dichloro-4-hydroxybenzaldehyde;CK-0709FD69855SY022958

Datenbank-Bezeichner

CAS: 60964-09-2
PubChem CID: 528382
DTXSID: DTXSID10336009
EC Number: 676-647-3
Nikkaji: J2.087.530E

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,8
Polarare Oberfläche (TPSA): 37,3 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 11
Formalladung: 0
Komplexität: 139

Physikochemische Eigenschaften

Schmelzpunkt: 227 · 227-229°C
Siedepunkt: 295.8 · 295.8±35.0 °C(Predicted)
Dichte: 1.547 · 1.547±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
pka: 5.87 · 5.87±0.23(Predicted)
Wasserlöslichkeit: Insoluble in water.

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 5 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

hs_code: 2913000090
hazard_code: Xi

Chemie und Industrie

Anwendungen

VerwendenAs starting reagents proposed to use 4-hydroxy-2,6-dimethylbenzaldehyde and 2,6-dichloro-4-hydroxybenzaldehyde easily available by straightforward syntheses from commercial products.