CAS 363134-35-4 4-Fluoro-3,5-dimethylbenzaldehyde (HCID 12040710)

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Grundinformationen

CAS: 363134-35-4
Standard-SMILES: Cc1cc(C=O)cc(C)c1F
InChIKey: NNHYTIOMCJAWLM-UHFFFAOYSA-N
Summenformel: C9H9FO
Durchschnittliche Molmasse: 152,16 g/mol
Monoisotopische Masse: 152,06374307

Namen und Bezeichner

Bevorzugter Name: 4-Fluoro-3,5-dimethylbenzaldehyde
IUPAC: 4-fluoro-3,5-dimethylbenzaldehyde
Englischer Name: Benzaldehyde, 4-fluoro-3,5-dimethyl- (9CI)
Summenformel: C9H9FO
Molmasse: 152.17

Namen und Synonyme

4-Fluoro-3,5-dimethylbenzaldehyde363134-35-4DTXSID00476367RefChem:292801DTXCID004271773,5-dimethyl-4-fluorobenzaldehydeMFCD06660264Benzaldehyde, 4-fluoro-3,5-dimethyl-BENZALDEHYDE, 4-FLUORO-3,5-DIMETHYL- (9CI)4-fluoro-3,5-dimethyl-benzaldehydeSCHEMBL493981NNHYTIOMCJAWLM-UHFFFAOYSA-N

Weitere Namen anzeigen

SBB086845AKOS010017190AS-41563SY227994DB-273572CS-0132493EN300-454174-Fluoro-3,5-dimethylbenzaldehyde, AldrichCPR

Datenbank-Bezeichner

CAS: 363134-35-4
PubChem CID: 12040710
DTXSID: DTXSID00476367
EC Number: 670-526-9

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,2
Polarare Oberfläche (TPSA): 17,1 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 11
Formalladung: 0
Komplexität: 134

Physikochemische Eigenschaften

Siedepunkt: 223.8 · 223.8±35.0 °C(Predicted)
Dichte: 1.103 · 1.103±0.06 g/cm3(Predicted)
Brechungsindex: 1.523 · 1.5230
storage temp.: 2 · 2-8°C, stored under nitrogen
Aggregatzustand: liquid
Farbe: Colourless
CAS Datenbank: 363134 · 363134-35-4

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

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, 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 4 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.