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N-Methylacridone
CAS: 719-54-0 | C14H11NO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
719-54-0
Molecular Formula:
C14H11NO
Molecular Mass:
209.25 g/mol
Names and Synonyms:
N-Methylacridone
10-Methyl-9-acridanone
10-Methylacridin-9-one
N-Methyl-9-acridone
10-Methyl-9(10H)-acridone
10-Methylacridone
10-Methyl-9-acridone
NSC 1189
NSC 54142
9,10-Dihydro-9-methyl-10-acridinone
10-Methyl-10H-acridin-9-one
9(10H)-Acridinone, 10-methyl-
9-Acridanone, 10-methyl-
10-Methyl-9(10H)-acridinone
N-Methylacridone
Identifiers:
SMILES:
Cn1c2ccccc2c(=O)c2ccccc21
InChI:
InChI=1S/C14H11NO/c1-15-12-8-4-2-6-10(12)14(16)11-7-3-5-9-13(11)15/h2-9H,1H3
Key Properties
Melting Point
155-170 °C
CAS Common Chemistry
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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 209.25 g/mol | CAS Common Chemistry |
| 209.248 g/mol | RDKit | |
| 209.084063972 g/mol | RDKit | |
| Canonical SMILES | O=C1C=2C=CC=CC2N(C=3C=CC=CC13)C | CAS Common Chemistry |
| InChI | InChI=1S/C14H11NO/c1-15-12-8-4-2-6-10(12)14(16)11-7-3-5-9-13(11)15/h2-9H,1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=XUVKSPPGPPFPQN-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 155-170 °C | CAS Common Chemistry |
| Name | N-Methylacridone | CAS Common Chemistry |
| Heavy Atom Count | 16 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 3 | RDKit |
| Topological Polar Surface Area | 22.0 Ų | RDKit |
| LogP | 2.691700000000001 | RDKit |
| Molar Refractivity | 66.69500000000004 | RDKit |
