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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
Names and Synonyms:
Phentermine Hydrochloride
Wilpo
Benzeneethanamine, α,α-dimethyl-, hydrochloride (1:1)
Phenethylamine, α,α-dimethyl-, hydrochloride
Benzeneethanamine, α,α-dimethyl-, hydrochloride
MG 18370
α-Methylamphetamine hydrochloride
Phentermine hydrochloride
1-Phenyl-2-methyl-2-aminopropane hydrochloride
α,α-Dimethylphenethylamine hydrochloride
1,1-Dimethyl-2-phenylethylamine hydrochloride
Obermine Black & Yellow
Adipex P
Fastin
2-Methyl-1-phenyl-2-propanamine hydrochloride
Adipex
Adipex-P
Identifiers:
SMILES:
CC(C)(N)Cc1ccccc1.Cl
InChI:
InChI=1S/C10H15N.ClH/c1-10(2,11)8-9-6-4-3-5-7-9;/h3-7H,8,11H2,1-2H3;1H
Key Properties
Melting Point
198 °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 | 185.70 g/mol | CAS Common Chemistry |
| 185.698 g/mol | RDKit | |
| 185.097127192 g/mol | RDKit | |
| 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 |
| Molar Refractivity | 55.66040000000003 | RDKit |
