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Hydrazine, (1-Methylethyl)-, Hydrochloride (1:1)
CAS: 16726-41-3 | C3H11ClN2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
16726-41-3
Molecular Formula:
C3H11ClN2
Molecular Weight:
110.58800000000001 g/mol
Names and Synonyms:
Hydrazine, (1-Methylethyl)-, Hydrochloride (1:1)
N-Isopropylhydrazine hydrochloride
Propan-2-ylhydrazine hydrochloride
Isopropylhydrazine hydrochloride
Hydrazine, isopropyl-, hydrochloride
Hydrazine, (1-methylethyl)-, monohydrochloride
Hydrazine, isopropyl-, monohydrochloride
Hydrazine, (1-methylethyl)-, hydrochloride (1:1)
Identifiers:
SMILES:
CC(C)NN.Cl
InChI:
InChI=1S/C3H10N2.ClH/c1-3(2)5-4;/h3,5H,4H2,1-2H3;1H
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
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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 |
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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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 110.58800000000001 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 110.06107603199999 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 6 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 1 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 38.05 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 0.2799000000000001 | RDKit |
| molecular_mass | 110.59 g/mol | Legacy Database |
| cas-canonical-smile | Cl.NNC(C)C None | Legacy Database |
| cas-inchi | InChI=1S/C3H10N2.ClH/c1-3(2)5-4;/h3,5H,4H2,1-2H3;1H None | Legacy Database |
| cas-inchi-key | InChIKey=ILULYDJFTJKQAP-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 114 °C None | Legacy Database |
| cas-name | Hydrazine, (1-methylethyl)-, hydrochloride (1:1) None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 29.707099999999993 | RDKit |
