(2-(trifluoromethyl)phenyl)acetic acid
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Grundinformationen
- CAS
3038-48-0- Standard-SMILES
O=C(O)Cc1ccccc1C(F)(F)F- InChIKey
TYOCDHCKTWANIR-UHFFFAOYSA-N- Summenformel
- C9H7F3O2
- Durchschnittliche Molmasse
- 204,15 g/mol
- Monoisotopische Masse
- 204,03981412
Namen und Bezeichner
- Bevorzugter Name
- (2-(trifluoromethyl)phenyl)acetic acid
- IUPAC
- 2-[2-(trifluoromethyl)phenyl]acetic acid
Namen und Synonyme
2-(Trifluoromethyl)phenylacetic acid3038-48-02-[2-(trifluoromethyl)phenyl]acetic acid2-(2-(Trifluoromethyl)phenyl)acetic acid[2-(trifluoromethyl)phenyl]acetic acidDTXSID90879681(2-(Trifluoromethyl)phenyl)acetic acidRefChem:395211221-240-4Benzeneacetic acid, 2-(trifluoromethyl)-MFCD00004327(alpha,alpha,alpha-Trifluoro-o-tolyl)acetic acid
Weitere Namen anzeigen
2-Trifluoromethylphenylacetic acid2-(Trifluoromethyl)benzeneacetic acido-Trifluoromethylphenylacetic acido-(Trifluoromethyl)benzeneacetic acid2-(Trifluoromethyl)phenylacetic acid, 98%AM20060021FT-0608972FT-0650772
Datenbank-Bezeichner
- CAS
3038-48-0- PubChem CID
- 594597
- DTXSID
DTXSID90879681- UNII
- 26224FDZ8F
- EC Number
- 221-240-4
- Nikkaji
- J205.347K
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 2,4
- Polarare Oberfläche (TPSA)
- 37,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 14
- Formalladung
- 0
- Komplexität
- 213
Experimentelle und physikochemische Eigenschaften
LogP2.59
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
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 48 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Toxikologische Informationen
Carcinogen Classification
Diethyl Phthalate/Dimethyl Phthalate
TR-429: Toxicology and Carcinogenesis Studies of Diethylphthalate (CASRN 84-66-2) in F344/N Rats and B6C3F1 Mice (Dermal Studies) with Dermal Initiation/Promotion Study of Diethylphthalate and Dimethylphthalate (CASRN 131-11-3) in Male Swiss (CD-1) Mice (1995 )
11/17/93
Dermal Initiation/ Promotion Study
Under the conditions of these 2-year dermal studies, there was no evidence of carcinogenic activity of diethylphthalate in male or female F344/N rats receiving 100 or 300 mL. The sensitivity of the male rat study was reduced due to low survival in all groups. There was equivocal evidence of carcinogenic activity of diethylphthalate in male and female B6C3F1 mice based on increased incidences of hepatocellular neoplasms, primarily adenomas.
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