N-Acetylisoleucine
Daten werden ergänzt – meist innerhalb einer Minute fertig
Grundinformationen
- CAS
3077-46-1- Standard-SMILES
CC[C@H](C)[C@H](NC(C)=O)C(=O)O- InChIKey
JDTWZSUNGHMMJM-FSPLSTOPSA-N- Summenformel
- C8H15NO3
- Durchschnittliche Molmasse
- 173,21 g/mol
- Monoisotopische Masse
- 173,10519334
Überblick
N-acetyl-L-isoleucine is an N-acetyl-L-amino acid that is L-isoleucine in which one of the nitrogens attached to the nitrogen is replaced by an acetyl group. It is a N-acetyl-L-amino acid, a N-acetylisoleucine and a L-isoleucine derivative. It is a conjugate acid of a N-acetyl-L-isoleucinate.
Namen und Bezeichner
- Bevorzugter Name
- N-Acetylisoleucine
- IUPAC
- (2S,3S)-2-acetamido-3-methylpentanoic acid
Namen und Synonyme
N-Acetyl-L-isoleucine3077-46-1L-Isoleucine, N-acetyl-N-AcetylisoleucineIsoleucine, N-acetyl-, L-P9CL0Y0BVZEINECS 221-364-9CHEBI:21555DTXSID101314843(+)-N-ACETYL-L-ISOLEUCINENSC 203807NSC-203807
Weitere Namen anzeigen
(2S,3S)-2-acetamido-3-methyl-pentanoic acidCHEBI:84056RefChem:828914DTXCID601744766221-364-92-acetamido-3-methylpentanoic acid(2S,3S)-2-acetamido-3-methylpentanoic acidAC-ILE-OH
Datenbank-Bezeichner
- CAS
3077-46-1- PubChem CID
- 7036275
- DTXSID
DTXSID101314843- ChEMBL
CHEMBL1221841- ChEBI
CHEBI:21555- UNII
- P9CL0Y0BVZ
- EC Number
- 221-364-9
- Nikkaji
- J102.445K
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 0,6
- Polarare Oberfläche (TPSA)
- 66,4 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 179
Experimentelle und physikochemische Eigenschaften
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
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 29 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Zugehörige Reaktionen
2
Notizen zur Verbindung
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