Back to Search
Acetylphenylhydrazine
CAS: 114-83-0 | C8H10N2O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
114-83-0
Molecular Formula:
C8H10N2O
Molecular Weight:
150.18099999999998 g/mol
Names and Synonyms:
Acetylphenylhydrazine
N′-Phenylacetohydrazide
N-(Phenylamino)acetamide
NSC 2847
NSC 229032
NSC 2064
Acetic acid phenylhydrazone
1-Phenyl-2-acetylhydrazine
N′-Phenylacethydrazide
N-Acetyl-N′-phenylhydrazine
β-Acetylphenylhydrazine
Acetylphenylhydrazine
Pyrodine
Pyrodin
Hydracetin
APH
1-Acetyl-2-phenylhydrazine
Acetic acid, 2-phenylhydrazide
Identifiers:
SMILES:
CC(O)=NNc1ccccc1
InChI:
InChI=1S/C8H10N2O/c1-7(11)9-10-8-5-3-2-4-6-8/h2-6,10H,1H3,(H,9,11)
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Category | Property | Value | Source |
|---|---|---|---|
| Molecular | Molecular Weight | 150.18099999999998 g/mol | RDKit |
| Exact | Exact Molecular Weight | 150.07931294 g/mol | RDKit |
| Heavy | Heavy Atom Count | 11 count | RDKit |
| Hydrogen | Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit | |
| Rotatable | Rotatable Bonds | 2 count | RDKit |
| Aromatic | Aromatic Ring Count | 1 count | RDKit |
| Topological | Topological Polar Surface Area | 44.620000000000005 Ų | RDKit |
| Physical Properties | LogP | 1.9898999999999998 | RDKit |
| molecular_mass | 150.18 g/mol | Legacy Database | |
| cas-canonical-smile | O=C(NNC=1C=CC=CC1)C | Legacy Database | |
| cas-inchi | InChI=1S/C8H10N2O/c1-7(11)9-10-8-5-3-2-4-6-8/h2-6,10H,1H3,(H,9,11) | Legacy Database | |
| cas-inchi-key | InChIKey=UICBCXONCUFSOI-UHFFFAOYSA-N | Legacy Database | |
| cas-melting-point | 131 °C | Legacy Database | |
| cas-name | Acetylphenylhydrazine | Legacy Database | |
| Molar | Molar Refractivity | 45.80250000000002 | RDKit |
