1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine (CAS 28289-54-5) — formula C12H15N, molecular weight 173.25; category organic chemicals.
| CAS Number | 28289-54-5 |
|---|---|
| Molecular Formula | C12H15N |
| Molecular Weight | 173.25 |
| Melting Point | 40-42 °C |
| Boiling Point | 85 to 90 °C @ 0.8 mm Hg |
| LogP | 2.7 |
| Applications | Uses: A contaminant produced during the synthesis of MPPP, a synthetic heroin, it causes irreversible parkinsonism in primates and is used in research laboratories, MPTP is converted to the toxic metabolite MPP+ in the brain where it selectively destroys cells in the substantia nigra. [Merck Index #6294], 1-methyl-4-phenyl-1, 2, 3, 6-tetrahydropyridine (MPTP) is a neurotoxin that causes permanent symptoms of Parkinson's disease by killing certain neurons in the substantia nigra of the brain. MPTP can be accidentally produced during the illicit manufacture of MPPP, and that is how its Parkinson-inducing effects were first discovered. MPTP is used to recreate and study the Parkinson's disease in experimental animal models., Methods of Manufacturing: Prepn as hydrochloride by Grignard reaction: A Ziering et al, J Org Chem 12, 894 (1947). Alternative prepn: CJ Schmidle, RC Mansfield, J Am Chem Soc 78, 425 (1956)., General Manufacturing Information: Identification as impurity in "synthetic heroin". |
| Category | Organic Chemicals |
Documented applications: Uses: A contaminant produced during the synthesis of MPPP, a synthetic heroin, it causes irreversible parkinsonism in primates and is used in research laboratories, MPTP is converted to the toxic metabolite MPP+ in the brain where it selectively destroys cells in the substantia nigra. [Merck Index #6294], 1-methyl-4-phenyl-1, 2, 3, 6-tetrahydropyridine (MPTP) is a neurotoxin that causes permanent symptoms of Parkinson's disease by killing certain neurons in the substantia nigra of the brain. MPTP can be accidentally produced during the illicit manufacture of MPPP, and that is how its Parkinson-inducing effects were first discovered. MPTP is used to recreate and study the Parkinson's disease in experimental animal models., Methods of Manufacturing: Prepn as hydrochloride by Grignard reaction: A Ziering et al, J Org Chem 12, 894 (1947). Alternative prepn: CJ Schmidle, RC Mansfield, J Am Chem Soc 78, 425 (1956)., General Manufacturing Information: Identification as impurity in "synthetic heroin"..
1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine is a carbon-based organic compound with CAS registry number 28289-54-5 and molecular formula C12H15N (molecular weight 173.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 28289-54-5
Its molecular formula C12H15N comprises 12 C, 15 H, 1 N atoms.
Also known as: 1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine · 1-甲基-4-苯基-1,2,3,6-四氢吡啶
Category: organic chemicals
The CAS registry number of 1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine is 28289-54-5.
Molecular formula C12H15N, molecular weight 173.25.
It is also registered under: 1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine, 1-甲基-4-苯基-1,2,3,6-四氢吡啶.
Recorded applications: Uses: A contaminant produced during the synthesis of MPPP, a synthetic heroin, it causes irreversible parkinsonism in primates and is used in research laboratories, MPTP is converted to the toxic metabolite MPP+ in the brain where it selectively destroys cells in the substantia nigra. [Merck Index #6294], 1-methyl-4-phenyl-1, 2, 3, 6-tetrahydropyridine (MPTP) is a neurotoxin that causes permanent symptoms of Parkinson's disease by killing certain neurons in the substantia nigra of the brain. MPTP can be accidentally produced during the illicit manufacture of MPPP, and that is how its Parkinson-inducing effects were first discovered. MPTP is used to recreate and study the Parkinson's disease in experimental animal models., Methods of Manufacturing: Prepn as hydrochloride by Grignard reaction: A Ziering et al, J Org Chem 12, 894 (1947). Alternative prepn: CJ Schmidle, RC Mansfield, J Am Chem Soc 78, 425 (1956)., General Manufacturing Information: Identification as impurity in "synthetic heroin"..
Category: Organic Chemicals.
Independent reference data for 1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine (CAS 28289-54-5), compiled from public chemistry databases.
| CAS Registry Number | 28289-54-5 |
|---|---|
| PubChem CID | 1388 |
| Molecular formula | C12H15N |
| IUPAC name | 1-methyl-4-phenyl-3,6-dihydro-2H-pyridine |
| UNII (FDA) | 9P21XSP91P |
| Molecular Weight | 173.25 |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 173.120449483 |
| Monoisotopic Mass | 173.120449483 |
| Topological Polar Surface Area | 3.2 |
| Heavy Atom Count | 13 |
| Boiling Point | 85 to 90 °C @ 0.8 mm Hg |
|---|---|
| Melting Point | 40-42 °C |
| Vapor Pressure | 0.00945 [mmHg] |
1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine; 28289-54-5; MPTP; PYRIDINE, 1,2,3,6-TETRAHYDRO-1-METHYL-4-PHENYL-; 1,2,3,6-Tetrahydro-1-methyl-4-phenylpyridine; DTXSID8040933; N-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine; 9P21XSP91P; NSC-139654; CHEBI:17963; RefChem:76325; DTXCID6020933; 248-939-7; 1-methyl-4-phenyl-3,6-dihydro-2H-pyridine; 1-METHYL-4-PHENYL-PIPERIDINE-3-EN; CCRIS 2186
| Reported hazard statements | H301 (100%), H370 (97.5%) |
|---|
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
H370 (97.5%): Causes damage to organs [Danger Specific target organ toxicity, single exposure]
1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine · CAS 28289-54-5 · C12H15N. UNII 9P21XSP91P. Boiling Point: 85 to 90 °C @ 0.8 mm Hg; Melting Point: 40-42 °C; Vapor Pressure: 0.00945 [mmHg].
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-甲基-4-苯基-1,2,3,6-四氢吡啶