4-methoxy-2-(trifluoromethyl)benzoic Acid

HCID 2775294CAS 127817-85-0
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Grundinformationen

Standard-SMILES
COc1ccc(C(=O)O)c(C(F)(F)F)c1
InChIKey
MLCRFQSWSHKLDP-UHFFFAOYSA-N
Summenformel
C9H7F3O3
Durchschnittliche Molmasse
220,14 g/mol
Monoisotopische Masse
220,03472857

Namen und Bezeichner

Bevorzugter Name
4-methoxy-2-(trifluoromethyl)benzoic Acid
IUPAC
4-methoxy-2-(trifluoromethyl)benzoic acid
Englischer Name
4-METHOXY-2-(TRIFLUOROMETHYL)BENZOIC ACID
Summenformel
C9H7F3O3
Molmasse
220.15

Namen und Synonyme

4-methoxy-2-(trifluoromethyl)benzoic Acid127817-85-0DTXSID80379504RefChem:293792DTXCID40330530630-215-0MFCD01091013Benzoic acid, 4-methoxy-2-(trifluoromethyl)-4-Methoxy-2-trifluormethylbenzoic acid4-methoxy-2-trifluoromethylbenzoic acid4-Methoxy-2-(trifluoromethyl)benzoicacidSCHEMBL1983309
Weitere Namen anzeigen
RARECHEM AL BE 11924-Methoxy-2-(Trifluoromethyl)BenzoicAci2-(Trifluoromethyl)-4-methoxybenzoic acid2-(Trifluoromethyl)-p-anisic acid, 2-Carboxy-5-methoxybenzotrifluoride, 4-Carboxy-3-(trifluoromethyl)anisole
MLCRFQSWSHKLDP-UHFFFAOYSA-NSBB064306AKOS005257330AC-3998CS-W014255FM70024FS-20892-trifluoromethyl-4-methoxybenzoic acid

Datenbank-Bezeichner

CAS
127817-85-0
PubChem CID
2775294
DTXSID
DTXSID80379504
EC Number
630-215-0

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,3
Polarare Oberfläche (TPSA)
46,5 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
6
Frei drehbare Bindungen
2
Schwere Atome
15

Physikochemische Eigenschaften

Schmelzpunkt
147 · 147-150°C
Siedepunkt
274.8 · 274.8±40.0 °C(Predicted)
Dichte
1.38 · 1.380±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
Aggregatzustand
solid
pka
3.5 · 3.50±0.36(Predicted)

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 6 reports by companies from 3 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

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

Sicherheitsdaten

hs_code
2918999090
hazard_code
Xi
hazard_note
Irritant

Chemie und Industrie

Anwendungen

Verwenden4-methoxy-2-(trifluoromethyl)benzoic acid is useful as a reactant for the synthesis of phenothiazines.

Vor- und nachgelagerte Produkte

Nachgelagerte Produkte

Anbieter50 Anbieter

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Changzhou Anxuan Chemical Co., Ltd+86-0519-89882563 +86-18961279162 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]

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