(S)-(+)-2-Amino-1-propanol - ≥98% , CAS No.2749-11-3

CAS: 2749-11-3 Cat. No.: A109243 Molecular Weight: 75.11 Beilstein Registry Number: 1718865 EC Number: 220-388-7

GRADE & PURITY ≥98%

Synonyms

A1085 | (S)-(-)-2-amino-1-propanol | A819092 | (2S)-(+)-2-aminopropan-1-ol | (S)-2-amino-propanol | 1-Propanol, 2-amino-, (2S)- | (25)-2-amino-1-propanol | A-4550 | SCHEMBL4546279 | (S)-alaninol | H-ALA-OL | Oprea1_346829 | UNII-V403GH89L1 | (S)-(+) 2-ami

Storage

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

Shipped In

Wet ice

Overview

(S)-(+)-2-Amino-1-propanol may be used in the preparation of unsymmetrical tridentate Schiff base ligands via condensation with carbonyl compounds.[4] It may also be used as a chiral auxillary for the preparation of tert-butyl 4-N-[(2-hydroxy-1-(S)-methyl)ethylamino]-2-methylene-4-(S)-phenyl-butyrate.

Specifications

Synonyms

A1085 | (S)-(-)-2-amino-1-propanol | A819092 | (2S)-(+)-2-aminopropan-1-ol | (S)-2-amino-propanol | 1-Propanol, 2-amino-, (2S)- | (25)-2-amino-1-propanol | A-4550 | SCHEMBL4546279 | (S)-alaninol | H-ALA-OL | Oprea1_346829 | UNII-V403GH89L1 | (S)-(+) 2-ami

Specifications & Purity

≥98%

Storage

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

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: CC(CO)N
• IUPAC Name: (2S)-2-aminopropan-1-ol
• InChIKey: BKMMTJMQCTUHRP-VKHMYHEASA-N
• INCHI: 1S/C3H9NO/c1-3(4)2-5/h3,5H,2,4H2,1H3/t3-/m0/s1
• Isomeric SMILES: C[C@@H](CO)N
• WGK Germany: 3
• UN Number: 2735
• Molecular Weight: 75.11
• Beilstein: 1718865
• Reaxy-Rn: 1209234
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1209234&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Alkanolamines
          • Level6 1,2-aminoalcohols

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Alkanolamines
• Direct Parent: 1,2-aminoalcohols
• Alternative Parents: Primary alcohols Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: 1,2-aminoalcohol - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Primary alcohol - Organooxygen compound - Primary aliphatic amine - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as 1,2-aminoalcohols. These are organic compounds containing an alkyl chain with an amine group bound to the C1 atom and an alcohol group bound to the C2 atom.
• External Descriptors: primary alcohol - primary amino compound - amino alcohol

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

Associated Targets(Human)

SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)

Discover Target: SLCO1B1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Solubility in water: Completely miscible; Very soluble in Alcohol
• Sensitivity: Air & Light & Moisture Sensitive
• Refractive Index: 1.4488-1.4508
• Specific Rotation[α]: 22 ° (C=2, EtOH)
• Flash Point(°F): 181.4℉
• Flash Point(°C): 83℃
• Boil Point(°C): 173-176°C
• Molecular Weight: 75.110 g/mol
• XLogP3: -1.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 75.0684 Da
• Monoisotopic Mass: 75.0684 Da
• Topological Polar Surface Area: 46.300 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 22.900
• 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

References

1. Xiaoping Wang, Hui Li, Kaijun Quan, Liang Zhao, Zuguang Li, Hongdeng Qiu.  (2021)  Anhydride-linked β-cyclodextrin-bonded silica stationary phases with enhanced chiral separation ability in liquid chromatography.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:34153735] [10.1016/j.chroma.2021.462338]