2-Amino-5-nitrobenzophenone - ≥98% , CAS No.1775-95-7

CAS: 1775-95-7 Cat. No.: A101330 Fórmula: C₁₃H₁₀N₂O₃ Peso molecular: 242.23 Beilstein Registry Number: 14,79 Número EC: 217-207-9

CALIDAD & PUREZA ≥98%

Synonyms

5-Nitro-2-aminobenzophenone | EN300-21016 | STK108012 | DTXSID40170317 | A1134 | (2-amino-5-nitrophenyl)(phenyl)methanone | Benzophenone, 2-amino-5-nitro- | MFCD00007364 | W-107828 | G2X8PCQ4GY | 2-Amino-5-nitrobenzophenone, >=98% | SCHEMBL333161 | SR-010

Storage

Room temperature

Shipped In

Normal

Descripción general

FT-IR and Raman spectra of 2-amino-5-nitrobenzophenone (ANBP) has been reported.

Especificaciones

Sinónimos

5-Nitro-2-aminobenzophenone | EN300-21016 | STK108012 | DTXSID40170317 | A1134 | (2-amino-5-nitrophenyl)(phenyl)methanone | Benzophenone, 2-amino-5-nitro- | MFCD00007364 | W-107828 | G2X8PCQ4GY | 2-Amino-5-nitrobenzophenone, >=98% | SCHEMBL333161 | SR-010

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

Pubchem Sid

488182161

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488182161

Sonrisas canónicas

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N

IUPAC Name

(2-amino-5-nitrophenyl)-phenylmethanone

InChIKey

PZPZDEIASIKHPY-UHFFFAOYSA-N

INCHI

1S/C13H10N2O3/c14-12-7-6-10(15(17)18)8-11(12)13(16)9-4-2-1-3-5-9/h1-8H,14H2

Isómeros SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N

WGK Alemania

3

RTECS

PC4935000

Peso molecular

242.23

Beilstein

14,79

Reaxy-Rn

748830

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=748830&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Benzophenones

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Benzophenones
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzophenones
• Alternative Parents: Diphenylmethanes Aryl-phenylketones Nitrobenzenes Nitroaromatic compounds Benzoyl derivatives Aniline and substituted anilines Vinylogous amides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Primary amines Organopnictogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzophenone - Diphenylmethane - Aryl-phenylketone - Nitrobenzene - Nitroaromatic compound - Benzoyl - Aryl ketone - Aniline or substituted anilines - Vinylogous amide - Ketone - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Organic zwitterion - Primary amine - Organooxygen compound - Organonitrogen compound - Organic oxide - Amine - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
• 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

Propiedades químicas y físicas

• Solubilidad: Soluble in chloroform, dichloromethane, dimethyl sulfoxide, ethyl acetate and methanol. Soluble in water 3 mg/L (20°C).
• Punto de fusión (°C): 161-168°C
• Peso molecular: 242.230 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 242.069 Da
• Monoisotopic Mass: 242.069 Da
• Topological Polar Surface Area: 88.900 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 321.000
• 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

Preguntas frecuentes

How should this product be stored?

Store at room temperature.

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1775-95-7, the molecular formula is C13H10N2O3, and the molecular weight is 242.23 g/mol. InChIKey PZPZDEIASIKHPY-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.