2-Chloro-3-methylbenzaldehyde

HCID 14492779

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Grundinformationen

CAS: 61563-28-8
Standard-SMILES: Cc1cccc(C=O)c1Cl
InChIKey: LGOLMLQWRYFRHP-UHFFFAOYSA-N
Summenformel: C8H7ClO
Durchschnittliche Molmasse: 154,59 g/mol
Monoisotopische Masse: 154,0185425

Namen und Bezeichner

Bevorzugter Name: 2-Chloro-3-methylbenzaldehyde
IUPAC: 2-chloro-3-methylbenzaldehyde
Englischer Name: 2-CHLORO-3-METHYLBENZAL DEHYDE
Summenformel: C8H7ClO
Molmasse: 154.59

Namen und Synonyme

2-Chloro-3-methylbenzaldehyde61563-28-8DTXSID50560942RefChem:258576DTXCID805117202-CHLORO-3-METHYLBENZAL DEHYDEMFCD11845907Benzaldehyde, 2-chloro-3-methyl-2-chloro-3-methylbenzaldehye2-chloro-3-methyl-benzaldehydeSCHEMBL2053017SCHEMBL5313673

Weitere Namen anzeigen

LGOLMLQWRYFRHP-UHFFFAOYSA-NLCA563282-Chloro-3-methylbenzaldehyde 95+%AKOS006345554DS-8875SY030838CS-0036697F037515

Datenbank-Bezeichner

CAS: 61563-28-8
PubChem CID: 14492779
DTXSID: DTXSID50560942
EC Number: 991-877-7

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,4
Polarare Oberfläche (TPSA): 17,1 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 1
Schwere Atome: 10
Formalladung: 0
Komplexität: 124

Physikochemische Eigenschaften

Siedepunkt: 228.4 · 228.4±20.0 °C(Predicted)
Dichte: 1.195 · 1.195±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): 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 (100%): 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 2 reports by companies from 1 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.