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Molecule
(3-Methoxyphenyl)Hydrazine Hydrochloride
CAS: 39232-91-2 · C7H11ClN2O
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 39232-91-2
- Molecular Formula
- C7H11ClN2O
- Molecular Mass
- 174.63 g/mol
Identifiers
CAS Registry Number
39232-91-2
SMILES
COc1cccc(NN)c1.Cl
InChI Key
GMXFZBZOVZOYNQ-UHFFFAOYSA-N
InChI
InChI=1S/C7H10N2O.ClH/c1-10-7-4-2-3-6(5-7)9-8;/h2-5,9H,8H2,1H3;1H
Names and Synonyms
- (3-Methoxyphenyl)Hydrazine Hydrochloride Synonym
- Hydrazine, (m-methoxyphenyl)-, hydrochloride Synonym
- Hydrazine, (3-methoxyphenyl)-, hydrochloride (1:1) Synonym
- Hydrazine, (3-methoxyphenyl)-, monohydrochloride Synonym
- m-Methoxyphenylhydrazine hydrochloride Synonym
- (3-Methoxyphenyl)hydrazine hydrochloride Synonym
- [3-(Methyloxy)phenyl]hydrazine monohydrochloride Synonym
- (3-Methoxyphenyl)hydrazine monohydrochloride Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 174.63 g/mol | CAS Common Chemistry |
| 174.63100000000003 g/mol | RDKit | |
| 174.631 g/mol | RDKit | |
| 174.628 g/mol | chempirical lib | |
| Canonical SMILES | Cl.O(C1=CC=CC(=C1)NN)C | CAS Common Chemistry |
| InChI | InChI=1S/C7H10N2O.ClH/c1-10-7-4-2-3-6(5-7)9-8;/h2-5,9H,8H2,1H3;1H | CAS Common Chemistry |
| InChI Key | InChIKey=GMXFZBZOVZOYNQ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 140-141 °C | CAS Common Chemistry |
| Name | (3-Methoxyphenyl)hydrazine hydrochloride | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 47.28 Ų | RDKit |
| LogP | 1.4025999999999998 | RDKit |
| 1.4026 | RDKit | |
| 1.47 | chempirical lib | |
| Molar Refractivity | 48.05210000000002 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.1429 | RDKit |
| 0.14 | chempirical lib | |
| Exact Mass | 174.055990652 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
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200 ppm
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 174.63 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C7H11ClN2O.
