Back to Search
Molecule
Phentermine Hydrochloride
CAS: 1197-21-3 · C10H16ClN
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 1197-21-3
- Molecular Formula
- C10H16ClN
- Molecular Mass
- 185.70 g/mol
Identifiers
CAS Registry Number
1197-21-3
SMILES
CC(C)(N)Cc1ccccc1.Cl
InChI Key
NCAIGTHBQTXTLR-UHFFFAOYSA-N
InChI
InChI=1S/C10H15N.ClH/c1-10(2,11)8-9-6-4-3-5-7-9;/h3-7H,8,11H2,1-2H3;1H
Names and Synonyms
- Phentermine Hydrochloride Common Name
- Wilpo Synonym
- Benzeneethanamine, α,α-dimethyl-, hydrochloride (1:1) Synonym
- Phenethylamine, α,α-dimethyl-, hydrochloride Synonym
- Benzeneethanamine, α,α-dimethyl-, hydrochloride Synonym
- MG 18370 Synonym
- α-Methylamphetamine hydrochloride Synonym
- Phentermine hydrochloride Synonym
- 1-Phenyl-2-methyl-2-aminopropane hydrochloride Synonym
- α,α-Dimethylphenethylamine hydrochloride Synonym
- 1,1-Dimethyl-2-phenylethylamine hydrochloride Synonym
- Obermine Black & Yellow Synonym
- Adipex P Synonym
- Fastin Synonym
- 2-Methyl-1-phenyl-2-propanamine hydrochloride Synonym
- Adipex Synonym
- Adipex-P Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 185.70 g/mol | CAS Common Chemistry |
| 185.698 g/mol | RDKit | |
| 185.695 g/mol | chempirical lib | |
| Canonical SMILES | Cl.NC(C)(C)CC=1C=CC=CC1 | CAS Common Chemistry |
| InChI | InChI=1S/C10H15N.ClH/c1-10(2,11)8-9-6-4-3-5-7-9;/h3-7H,8,11H2,1-2H3;1H | CAS Common Chemistry |
| InChI Key | InChIKey=NCAIGTHBQTXTLR-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 198 °C | CAS Common Chemistry |
| Name | Phentermine hydrochloride | CAS Common Chemistry |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 26.02 Ų | RDKit |
| LogP | 2.3882000000000008 | RDKit |
| 2.3882 | RDKit | |
| Molar Refractivity | 55.66040000000003 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.4 | RDKit |
| Exact Mass | 185.097127192 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
Convert
Quick conversion
MW = 185.70 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C10H16ClN.
