Kehua AI (Shenzhen) Innovative Drug R&D Co., Ltd.    Healthy Roots Biotechnology (Shenzhen) Co., Limited    Joint Development

1. Primary Information

English name: 4'-Aminoacetophenone
CAS No.: 99-92-3
Molecular formula: C8H9NO
Molecular weight: 135.16 g/mol
SMILES: CC(=O)C1=CC=C(C=C1)N
Structural class:
Other identifiers:

4-aminoacetophenone

p-aminoacetophenone

para-aminoacetophenone

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 100mg HPLC≥98% 320 2-8℃ in stock -
Kehua Intelligence 25g AR,98% 32 2-8℃ in stock -
Kehua Intelligence 100g AR,98% 96 2-8℃ in stock -
Kehua Intelligence 500g AR,98% 440 2-8℃ in stock -

3. Structures

3.1 2D structure


3.2 3D structure


4. International Nomenclature & Identifiers

4.1 IUPAC Name

1-(4-aminophenyl)ethanone


4.2 InChI

InChI=1S/C8H9NO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,9H2,1H3


4.3 InChIKey

GPRYKVSEZCQIHD-UHFFFAOYSA-N


4.4 Canonical SMILES

CC(=O)C1=CC=C(C=C1)N


4.5 Isomeric SMILES

-

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon