2'-Aminoacetophenone - ≥97% , CAS No.551-93-9

CAS: 551-93-9 Cat. No.: A107199 Molecular Weight: 135.16 Beilstein Registry Number: 386122 EC Number: 209-002-8

GRADE & PURITY ≥97%

Synonyms

EINECS 209-002-8 | 2'aminoacetophenone | 2'-Aminoacetophenone | NSC 8820 | HY-I0501 | 2'-Aminoacetophenone, >=98% | 5 kaal | PS-4579 | STR00923 | 1-(2-Aminophenyl)Ethan-1-One | o-Amino acetophenone | 2'-Amonioacetophenone | A0250 | HSDB 5494 | 1-(2-aminop

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

EINECS 209-002-8 | 2'aminoacetophenone | 2'-Aminoacetophenone | NSC 8820 | HY-I0501 | 2'-Aminoacetophenone, >=98% | 5 kaal | PS-4579 | STR00923 | 1-(2-Aminophenyl)Ethan-1-One | o-Amino acetophenone | 2'-Amonioacetophenone | A0250 | HSDB 5494 | 1-(2-aminop

Specifications & Purity

≥97%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

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

Action Type

INHIBITOR

Purity

≥97%

Names and Identifiers

• Pubchem Sid: 488181253
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181253
• Canonical Smiles: CC(=O)C1=CC=CC=C1N
• IUPAC Name: 1-(2-aminophenyl)ethanone
• InChIKey: GTDQGKWDWVUKTI-UHFFFAOYSA-N
• INCHI: 1S/C8H9NO/c1-6(10)7-4-2-3-5-8(7)9/h2-5H,9H2,1H3
• Isomeric SMILES: CC(=O)C1=CC=CC=C1N
• WGK Germany: 3
• RTECS: AM5775000
• Molecular Weight: 135.16
• Beilstein: 386122
• Reaxy-Rn: 386122
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=386122&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Ketones
          • Level6 Aryl ketones
            • Level7 Phenylketones
              • Level8 Alkyl-phenylketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones - Aryl ketones - Phenylketones
• Direct Parent: Alkyl-phenylketones
• Alternative Parents: Acetophenones Benzoyl derivatives Aryl alkyl ketones Aniline and substituted anilines Vinylogous amides Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Alkyl-phenylketone - Acetophenone - Benzoyl - Aryl alkyl ketone - Aniline or substituted anilines - Benzenoid - Monocyclic benzene moiety - Vinylogous amide - Amine - Primary amine - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
• 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

Associated Targets(non-human)

Thrips tabaci (33 Activities)

Explore this target

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: practically insoluble
• Sensitivity: Under Inert Atmosphere
• Refractive Index: 1.614
• Flash Point(°F): 235.4 °F
• Flash Point(°C): 113 °C
• Boil Point(°C): 85-90°C
• Molecular Weight: 135.160 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 135.068 Da
• Monoisotopic Mass: 135.068 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 133.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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. Li Zheng, Jun-jian Situ, Qing-feng Zhu, Ping-gen Xi, Yin Zheng, Hong-xia Liu, Xiaofan Zhou, Zi-de Jiang.  (2019)  Identification of volatile organic compounds for the biocontrol of postharvest litchi fruit pathogen Peronophythora litchii.  POSTHARVEST BIOLOGY AND TECHNOLOGY,      [PMID:] [10.1016/j.postharvbio.2019.05.009]

2. Yuxin Yang, Chunhua Lou, Huixiao Wang, Jingjing Yu.  (2025)  Synthesis and Curing Kinetics of O-aminoacetophenone-modified Dicyandiamide Curing Agents for Epoxy Resin.  THERMOCHIMICA ACTA,      [PMID:] [10.1016/j.tca.2025.179963]