Grundinformationen
- Standard-SMILES
Nc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1- InChIKey
GADGMZDHLQLZRI-VIFPVBQESA-N- Summenformel
- C12H14N2O5
- Durchschnittliche Molmasse
- 266,25 g/mol
- Monoisotopische Masse
- 266,09027155
Namen und Bezeichner
- Bevorzugter Name
- N-(4-Aminobenzoyl)-L-glutamic acid
- IUPAC
- (2S)-2-[(4-aminobenzoyl)amino]pentanedioic acid
Namen und Synonyme
N-(4-Aminobenzoyl)-L-glutamic acid4271-30-1N-(p-Aminobenzoyl)glutamic acidp-Aminobenzoyl-L-glutamic acidp-Aminobenzoylglutamic acid4-Aminobenzoylglutamic acidL-N-(p-Aminobenzoyl)glutamic acidL-Glutamic acid, N-(4-aminobenzoyl)-9BKY99A8HJCHEBI:61114DTXSID10873641NSC-71042
Weitere Namen anzeigen
PABGARefChem:162076glutamyl-p-aminobenzoic acidpara-aminobenzoylglutamic acidDTXCID80149845224-261-7(S)-2-(4-Aminobenzamido)pentanedioic acidMFCD00042821
Datenbank-Bezeichner
- CAS
4271-30-1- PubChem CID
- 196473
- DTXSID
DTXSID10873641- ChEMBL
CHEMBL3278332- ChEBI
CHEBI:61114- UNII
- 9BKY99A8HJ
- EC Number
- 224-261-7
- Nikkaji
- J15.173D
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0
- Polarare Oberfläche (TPSA)
- 130 Ų
- H-Brücken-Donoren
- 4
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 19
- Formalladung
- 0
- Komplexität
- 350
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (33.3%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H334 (33.3%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]；H335 (33.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, 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.；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
Regulatory InformationN-(4-Aminobenzoyl)-L-glutamic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesSkin Sens. 1 (33.3%)；Resp. Sens. 1 (33.3%)
Regulatorische Informationen
Regulatory InformationN-(4-Aminobenzoyl)-L-glutamic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Zugehörige Reaktionen
1
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