Benzenepropanamide,N-(4-nitrophenyl)-b-oxo

Modify Date: 2026-07-03 06:30:43

Benzenepropanamide,N-(4-nitrophenyl)-b-oxo Structure
Benzenepropanamide,N-(4-nitrophenyl)-b-oxo structure
 Common Name Benzenepropanamide,N-(4-nitrophenyl)-b-oxo
CAS Number 968-29-6 Molecular Weight 284.26700
Density 1.351g/cm3 Boiling Point 554ºC at 760mmHg
Molecular Formula C15H12N2O4 Melting Point N/A
MSDS N/A Flash Point 288.9ºC

Summary: N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide (Chinese name: N-(4-硝基苯基)-3-氧基-3-苯基丙酰胺, CAS number: 968-29-6, molecular formula: C15H12N2O4, molecular weight: 284.26), For research-use only, not for medical or clinical usage.

 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide
Synonym More Synonyms

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density 1.351g/cm3
Boiling Point 554ºC at 760mmHg
Molecular Formula C15H12N2O4
Molecular Weight 284.26700
Flash Point 288.9ºC
Exact Mass 284.08000
PSA 91.99000
LogP 3.40250
Index of Refraction 1.649
InChIKey QVWSMRKZRQSUSV-UHFFFAOYSA-N
SMILES O=C(CC(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1

 Synthetic Route

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

Ethyl 3-oxo-3-phenylpropanoate structure

Ethyl 3-oxo-3-p...

CAS#:94-02-0

4-Nitroaniline structure

4-Nitroaniline

CAS#:100-01-6

~73%

Benzenepropanamide,N-(4-nitrophenyl)-b-oxo Structure

Benzenepropanam...

CAS#:968-29-6

Learn More
Literature: Abdel-Rahman, R. M. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1988 , vol. 27, p. 548 - 553

 Precursor & DownStream

This table lists upstream starting materials and downstream derivative products related to this chemical.

Precursor  2

DownStream  1

 Bioassay

View more

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1100
Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1101
Name: Schnurri-3 Inhibitors: specific inducers of adult bone formation Measured in Cell-Bas...
Source: Broad Institute
Target: N/A
External Id: 2134-01_Inhibitor_SinglePoint_HTS_Activity_Set2
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: High throughput screen for small molecule inhibitors of a hypoxia-regulated fluoresce...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: N/A
External Id: HMS1149-MLP
Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
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 Synonyms

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

Benzoylessigsaeure-<4-nitro-anilid>
p-nitroanilide of benzoylacetic acid
benzoylaceto-2-nitroanilide
Benzoylessigsaeure-<2-nitro-anilid>
4-Nitro-benzoylacetanilid

  | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What are the upstream materials of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide?
A: Related upstream materials(CAS) of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide: 94-02-0;100-01-6.
Q: What is the polar surface area (PSA) of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide?
A: Polar surface area (PSA) of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide is 91.99000.
Q: What is the English name of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide?
A: The English name of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide is N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide.
Q: What is the CAS number of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide?
A: CAS number of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide is 968-29-6.
Q: What is the boiling point of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide?
A: Boiling point of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide is 554ºC at 760mmHg.
Q: What is the SMILES notation of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide?
A: SMILES notation of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide is O=C(CC(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1.
Q: What is the molecular weight of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide?
A: Molecular weight of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide is 284.26700.
Q: What is the LogP of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide?
A: LogP of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide is 3.40250.
Q: What is the InChIKey of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide?
A: InChIKey of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide is QVWSMRKZRQSUSV-UHFFFAOYSA-N.
Q: What are the downstream products of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide?
A: Related downstream products(CAS) of N-(4-nitrophenyl)-3-oxo-3-phenylpropanamide: 103-94-6.

 factory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Dayang Chem (Hangzhou) Co., Ltd.
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