2-Aminophenylacetamide - Reagent Grade, ≥98% , CAS No.4103-60-0

CAS: 4103-60-0 Cat. No.: A479051 분자식: C₈H₁₀N₂O 분자량: 150.18 EC 번호: 871-990-7

GRADE & PURITY Reagent Grade, ≥98%

Synonyms

(2-carbamoylmethyl-phenyl)-amine | 2-(2-aminophenyl)acetamide | SCHEMBL1039164 | EN300-35913 | Z239125326 | AB26281 | NSC127700 | NSC-127700 | a-aminophenylacetamide | AKOS000130385 | TXMURLRUEUBDHN-UHFFFAOYSA-N | 2-aminophenylacetamide, AldrichCPR | D785

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

동의어

(2-carbamoylmethyl-phenyl)-amine | 2-(2-aminophenyl)acetamide | SCHEMBL1039164 | EN300-35913 | Z239125326 | AB26281 | NSC127700 | NSC-127700 | a-aminophenylacetamide | AKOS000130385 | TXMURLRUEUBDHN-UHFFFAOYSA-N | 2-aminophenylacetamide, AldrichCPR | D785

사양 및 순도

Reagent Grade, ≥98%

보관 조건

Store at -20°C

배송

Ice chest + Ice pads

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등급

Reagent Grade

순수함

≥98%

이름과 식별자

• 정식 스마일: C1=CC=C(C(=C1)CC(=O)N)N
• IUPAC Name: 2-(2-aminophenyl)acetamide
• InChIKey: TXMURLRUEUBDHN-UHFFFAOYSA-N
• INCHI: 1S/C8H10N2O/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5,9H2,(H2,10,11)
• 이성체 SMILES: C1=CC=C(C(=C1)CC(=O)N)N
• 분자량: 150.18
• Reaxy-Rn: 2803068
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2803068&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass Phenylacetamides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Phenylacetamides
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylacetamides
• Alternative Parents: Aniline and substituted anilines Primary carboxylic acid amides Amino acids and derivatives Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylacetamide - Aniline or substituted anilines - Amino acid or derivatives - Carboxamide group - Primary carboxylic acid amide - Carboxylic acid derivative - Amine - Hydrocarbon derivative - Organic oxide - Primary amine - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as phenylacetamides. These are amide derivatives of phenylacetic acids.
• 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

화학 및 물리적 특성

• 발화점(°F): Not applicable
• 발화점(°C): Not applicable
• 분자량: 150.180 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 150.079 Da
• Monoisotopic Mass: 150.079 Da
• Topological Polar Surface Area: 69.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 147.000
• 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