Grundinformationen
- Standard-SMILES
Nc1ccccc1C(=O)OCc1ccccc1- InChIKey
ZHZPDMZPDWXVMJ-UHFFFAOYSA-N- Summenformel
- C14H13NO2
- Durchschnittliche Molmasse
- 227,26 g/mol
- Monoisotopische Masse
- 227,09462866
Namen und Bezeichner
- Bevorzugter Name
- Benzyl anthranilate
- IUPAC
- benzyl 2-aminobenzoate
- Englischer Name
- Benzyl anthranilate
- Summenformel
- C14H13NO2
- Molmasse
- 227.26
Namen und Synonyme
Benzyl anthranilateBenzoic acid, 2-amino-, phenylmethyl esterEINECS 279-911-2DTXSID10231606RefChem:118855DTXCID00154097279-911-2ZHZPDMZPDWXVMJ-UHFFFAOYSA-NBenzyl 2-aminobenzoate82185-41-9MFCD000606052-Aminobenzoic acid benzyl ester
Weitere Namen anzeigen
B860277 Benzyl Anthranilate,≥97%2-amino-benzoicaciphenylmethylester2-aminobenzoic acid (phenylmethyl) esterBenzyl anthranilate, Phenylmethyl 2-aminobenzoate
Benzyl 2-aminobenzoate #phenylmethyl 2-aminobenzoateanthranilic acid benzyl esterOprea1_030897SCHEMBL445585SCHEMBL6985262SCHEMBL29394630SBB017812
Datenbank-Bezeichner
- CAS
82185-41-9- PubChem CID
- 522771
- DTXSID
DTXSID10231606- EC Number
- 279-911-2
- Nikkaji
- J284.152E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,4
- Polarare Oberfläche (TPSA)
- 52,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 17
- Formalladung
- 0
- Komplexität
- 249
Physikochemische Eigenschaften
- Schmelzpunkt
- 76 °C · 76 °C
- Siedepunkt
- 206 °C/7mmHg · 206°C/7mmHg(lit.)
- Löslichkeit
- soluble in Methanol
- Aggregatzustand
- powder to crystal
- Farbe
- White to Light yellow to Light orange
- Geruch (Odor)
- 100 % · at 100.00 %. floral grapefruit lily
- Geruchsart
- citrus
- LogP
- 3.865 · 3.865 (est)
- CAS Datenbank
- 82185 · 82185-41-9(CAS DataBase Reference)
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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Benzoic acid, 2-amino-, phenylmethyl ester
Benzoic acid, 2-amino-, phenylmethyl ester: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Benzoic acid, 2-amino-, phenylmethyl ester: Human health tier I assessment
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- hs_code
- 2921.42.9000
- hazard_code
- Xi
- hazard_class
- IRRITANT
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