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Salicylaldehyde Salicyloylhydrazone
CAS: 3232-36-8 | C14H12N2O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
3232-36-8
Molecular Formula:
C14H12N2O3
Molecular Mass:
256.26 g/mol
Names and Synonyms:
Salicylaldehyde Salicyloylhydrazone
Benzoic acid, 2-hydroxy-, 2-[(2-hydroxyphenyl)methylene]hydrazide
Salicylic acid, salicylidenehydrazide
Benzoic acid, 2-hydroxy-, [(2-hydroxyphenyl)methylene]hydrazide
Hydrazine, 1-salicylidene-2-salicyloyl-
Salicyl N-salicylidenehydrazide
N-Salicylidene-N′-salicylhydrazide
N-Salicylidene-N′-salicyloylhydrazine
N′-Salicylidenesalicylic acid hydrazide
Chel 180
Salicylic salicylidenehydrazide
Salicylaldehyde salicyloylhydrazone
NSC 692002
NSC 87864
Salicylaldehyde 2-hydroxybenzoylhydrazone
Identifiers:
SMILES:
OC(=NN=Cc1ccccc1O)c1ccccc1O
InChI:
InChI=1S/C14H12N2O3/c17-12-7-3-1-5-10(12)9-15-16-14(19)11-6-2-4-8-13(11)18/h1-9,17-18H,(H,16,19)
Key Properties
Melting Point
277 °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 | 256.26 g/mol | CAS Common Chemistry |
| 256.26099999999997 g/mol | RDKit | |
| 256.084792244 g/mol | RDKit | |
| Canonical SMILES | O=C(NN=CC=1C=CC=CC1O)C=2C=CC=CC2O | CAS Common Chemistry |
| InChI | InChI=1S/C14H12N2O3/c17-12-7-3-1-5-10(12)9-15-16-14(19)11-6-2-4-8-13(11)18/h1-9,17-18H,(H,16,19) | CAS Common Chemistry |
| InChI Key | InChIKey=OMCYEZUIYGPHDJ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 277 °C | CAS Common Chemistry |
| Name | Salicylaldehyde salicyloylhydrazone | CAS Common Chemistry |
| Heavy Atom Count | 19 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 85.41000000000001 Ų | RDKit |
| LogP | 2.436500000000001 | RDKit |
| Molar Refractivity | 72.97340000000001 | RDKit |
