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Molecule
Hydrazine, (2,3-Dimethylphenyl)-, Hydrochloride (1:1)
CAS: 56737-75-8 · C8H13ClN2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 56737-75-8
- Molecular Formula
- C8H13ClN2
- Molecular Mass
- 172.66 g/mol
Identifiers
CAS Registry Number
56737-75-8
SMILES
Cc1cccc(NN)c1C.Cl
InChI Key
UKAYNIJBIXNDDJ-UHFFFAOYSA-N
InChI
InChI=1S/C8H12N2.ClH/c1-6-4-3-5-8(10-9)7(6)2;/h3-5,10H,9H2,1-2H3;1H
Names and Synonyms
- Hydrazine, (2,3-Dimethylphenyl)-, Hydrochloride (1:1) Synonym
- Hydrazine, (2,3-dimethylphenyl)-, hydrochloride (1:1) Synonym
- Hydrazine, (2,3-dimethylphenyl)-, monohydrochloride Synonym
- (2,3-Dimethylphenyl)hydrazine hydrochloride Synonym
- N-(2,3-Dimethylphenyl)hydrazine hydrochloride Synonym
- 1-(2,3-Dimethylphenyl)hydrazine hydrochloride Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 172.66 g/mol | CAS Common Chemistry |
| 172.65900000000002 g/mol | RDKit | |
| 172.659 g/mol | RDKit | |
| 172.656 g/mol | chempirical lib | |
| Canonical SMILES | Cl.NNC1=CC=CC(=C1C)C | CAS Common Chemistry |
| InChI | InChI=1S/C8H12N2.ClH/c1-6-4-3-5-8(10-9)7(6)2;/h3-5,10H,9H2,1-2H3;1H | CAS Common Chemistry |
| InChI Key | InChIKey=UKAYNIJBIXNDDJ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Hydrazine, (2,3-dimethylphenyl)-, hydrochloride (1:1) | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 38.05 Ų | RDKit |
| LogP | 2.0108400000000004 | RDKit |
| 2.0108 | RDKit | |
| 2.15 | chempirical lib | |
| Molar Refractivity | 50.974100000000014 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.25 | RDKit |
| Exact Mass | 172.076726096 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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3
2
1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
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20
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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 = 172.66 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C8H13ClN2.
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Hydrazine, (2-ethylphenyl)-, hydrochloride (1:?)
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Hydrazine, (3,5-Dimethylphenyl)-, Hydrochloride (1:1)
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Hydrazine, (3,4-Dimethylphenyl)-, Hydrochloride (1:1)
CAS 60481-51-8
