(S)-1-(4-Fluorophenyl)ethanamine - ≥98% , CAS No.66399-30-2

CAS: 66399-30-2 Cat. No.: S589825 Formula: C₈H₁₀FN Peso molecolare: 139.17 Numero EC: 679-261-3

GRADE & PURITY ≥98%

Synonyms

J-500389 | PS-9383 | (S-)-1-(4-fluorophenyl)ethylamine | (S)-1-(4-Fluorophenyl)ethylamine | (S)-1-(4-fluoro-phenyl)ethylamine | (S)-1-(4-FLUORO-PHENYL)-ETHYLAMINE | (S)-1-(4-fluorophenyl)-ethylamine | (S)-4-Fluoro-alpha-methylbenzylamine, ChiPros(R), prod

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Sinonimi

J-500389 | PS-9383 | (S-)-1-(4-fluorophenyl)ethylamine | (S)-1-(4-Fluorophenyl)ethylamine | (S)-1-(4-fluoro-phenyl)ethylamine | (S)-1-(4-FLUORO-PHENYL)-ETHYLAMINE | (S)-1-(4-fluorophenyl)-ethylamine | (S)-4-Fluoro-alpha-methylbenzylamine, ChiPros(R), prod

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Protected from light,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98%

Nomi e identificatori

Pubchem Sid

508806779

Sorrisi canonici

CC(C1=CC=C(C=C1)F)N

IUPAC Name

(1S)-1-(4-fluorophenyl)ethanamine

InChIKey

QGCLEUGNYRXBMZ-LURJTMIESA-N

INCHI

1S/C8H10FN/c1-6(10)7-2-4-8(9)5-3-7/h2-6H,10H2,1H3/t6-/m0/s1

Isomeri SMILES

C[C@@H](C1=CC=C(C=C1)F)N

Numero UN

2735

Gruppo di imballaggio

II

Peso molecolare

139.17

Reaxy-Rn

2802417

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2802417&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Fluorobenzenes
• Alternative Parents: Aralkylamines Aryl fluorides Organopnictogen compounds Organofluorides Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aralkylamine - Fluorobenzene - Aryl halide - Aryl fluoride - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Primary aliphatic amine - Amine - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
• External Descriptors: Not available

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

Proprietà chimiche e fisiche

• Sensibilità: Air sensitive
• Punto di ebollizione (°C): 72 °C/21 mmHg
• Punto di fusione (°C): 68 °C
• Peso molecolare: 139.170 g/mol
• XLogP3: 1.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 139.08 Da
• Monoisotopic Mass: 139.08 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 97.400
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1