2-Methoxy-6-(trifluoromethyl)benzoic acid
Grundinformationen
- CAS
119692-41-0- Standard-SMILES
COc1cccc(C(F)(F)F)c1C(=O)O- InChIKey
IOJYMQXQDCJQBF-UHFFFAOYSA-N- Summenformel
- C9H7F3O3
- Durchschnittliche Molmasse
- 220,14 g/mol
- Monoisotopische Masse
- 220,03472857
Namen und Bezeichner
- Bevorzugter Name
- 2-Methoxy-6-(trifluoromethyl)benzoic acid
- IUPAC
- 2-methoxy-6-(trifluoromethyl)benzoic acid
- Englischer Name
- 2-Methoxy-6-(trifluoromethyl)benzoic acid
- Summenformel
- C9H7F3O3
- Molmasse
- 220.15
Namen und Synonyme
2-Methoxy-6-(trifluoromethyl)benzoic acid119692-41-0DTXSID80566997RefChem:262670DTXCID70517771630-204-0MFCD09832319Benzoic acid, 2-methoxy-6-(trifluoromethyl)-SCHEMBL425534AKOS015956452CS-W0131482-methoxy-6-trifluoromethylbenzoic acid
Weitere Namen anzeigen
2-Methoxy-6-(trifluoromethyl)2-Methoxy-6-(trifluoromethyl)benzoicacid,97%2-Methoxy-6-(trifluoromethyl)benzoic acid, JRD, 97%
6-methoxy-2 trifluoromethylbenzoic acidJS-4671SBB0959006-methoxy-2-trifluoromethylbenzoic acid2-Methoxy-6-(trifluoromethyl)benzoicacid2-Methoxy-6-trifluoromethyl-benzoic acidSY2279536-methoxy-2-(trifluoromethyl)benzoic acid
Datenbank-Bezeichner
- CAS
119692-41-0- PubChem CID
- 15017533
- DTXSID
DTXSID80566997- EC Number
- 630-204-0
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
- Formalladung
- 0
- Komplexität
- 239
Physikochemische Eigenschaften
- Schmelzpunkt
- 131 · 131-134℃
- storage temp.
- Store at room temperature
- InChI
- InChI=1S/C9H7F3O3/c1-15-6-4-2-3-5(9(10,11)12)7(6)8(13)14/h2-4H,1H3,(H,13,14)
- InChIKey
- IOJYMQXQDCJQBF-UHFFFAOYSA-N
- SMILES
- C(O)(=O)C1=C(C(F)(F)F)C=CC=C1OC
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
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 5 reports by companies from 2 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
Chemie und Industrie
Anbieter29 Anbieter
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Aladdin Scientific[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
南京代盟化工有限公司02566880956 · [email protected]
天津林宸科技有限公司15122256084 15122256084 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
湖北丽都新材料科技有限公司19307245857 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
嘉兴市德亿化工有限公司
Zugehörige Reaktionen
18
Notizen zur Verbindung
Wird geladen…