2-Amino-1-phenylethanol - 10mM in DMSO , CAS No.7568-93-6

CAS: 7568-93-6 Cat. No.: A425852 Summenformel: C₈H₁₁NO Molekulargewicht: 137.18 Beilstein Registry Number: 971222 EG-Nummer: 231-469-1

GRADE & PURITY 10mM in DMSO

Synonyms

(RS)-2-Amino-1-phenylethanol | Benzenemethanol, alpha-(aminomethyl)- (VAN) | beta-Hydroxy-beta-phenylethylamine | beta-hydroxy-beta-phenyl-Ethylamine | BRN 0971222 | Oprea1_790333 | (+-)-Phenylethanolamine | NSC5021 | NSC-5021 | Phenylethanolamin | (1R)-2

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifications

Synonyme

(RS)-2-Amino-1-phenylethanol | Benzenemethanol, alpha-(aminomethyl)- (VAN) | beta-Hydroxy-beta-phenylethylamine | beta-hydroxy-beta-phenyl-Ethylamine | BRN 0971222 | Oprea1_790333 | (+-)-Phenylethanolamine | NSC5021 | NSC-5021 | Phenylethanolamin | (1R)-2

Spezifikationen & Reinheit

10mM in DMSO

Storage

Store at -80°C

Verschickt in

Dry ice packs + Cold packs

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Namen und Kennungen

• Pubchem Sid: 528756497
• Kanonisches Lächeln: C1=CC=C(C=C1)C(CN)O
• IUPAC Name: 2-amino-1-phenylethanol
• InChIKey: ULSIYEODSMZIPX-UHFFFAOYSA-N
• INCHI: 1S/C8H11NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2
• Isomere SMILES: C1=CC=C(C=C1)C(CN)O
• WGK Deutschland: 3
• RTECS: DN5500000
• Molekulargewicht: 137.18
• Beilstein: 971222
• Reaxy-Rn: 971222
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=971222&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Amines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aralkylamines
• Alternative Parents: Benzene and substituted derivatives Secondary alcohols 1,2-aminoalcohols Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aralkylamine - Benzenoid - Monocyclic benzene moiety - Secondary alcohol - 1,2-aminoalcohol - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic alcohol - Primary amine - Organooxygen compound - Primary aliphatic amine - Alcohol - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl group.
• External Descriptors: phenylethanolamines

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: air sensitive
• Schmelzpunkt (°C): 57 °C
• Molekulargewicht: 137.180 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 137.084 Da
• Monoisotopic Mass: 137.084 Da
• Topological Polar Surface Area: 46.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 89.300
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1