Basic information
- CAS
63867-26-5- Standard SMILES
CC(C[NH+](C)C)C(C#N)(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
JJLGTRNWSYAQKN-UHFFFAOYSA-N- Molecular formula
- C19H23ClN2
- Average molar mass
- 314.9 g/mol
- Monoisotopic mass
- 314.1549764
Names & identifiers
- Preferred name
- Benzeneacetonitrile, alpha-(2-(dimethylamino)-1-methylethyl)-alpha-phenyl-, monohydrochloride
- IUPAC
- (3-cyano-2-methyl-3,3-diphenylpropyl)-dimethylazanium chloride
- English name
- (3RS)-4-(Dimethylamino)-3-methyl-2,
- Molecular formula
- C19H23ClN2
- Molecular weight
- 314.86
Names & synonyms
63867-26-5RefChem:1078362Benzeneacetonitrile, alpha-(2-(dimethylamino)-1-methylethyl)-alpha-phenyl-, monohydrochloride4-Dimethylamino-2,2-diphenyl-3-methylbutyronitrile hydrochlorideWIN 1423(3RS)-4-(dimethylamino)-3-methyl-2,2- diphenylbutanenitrileBUTYRONITRILE, 4-DIMETHYLAMINO-2,2-DIPHENYL-3-METHYL-, HYDROCHLORIDE(3-cyano-2-methyl-3,3-diphenylpropyl)-dimethylazanium;chlorideControlled Substance<br>(Levomethadone hydrochloride EP Impurity C;<br>Methadone EP Impurity C)Methadone Related Compound C as HydrochlorideMethadone USP Related Compound C as HydrochlorideMethadone Hydrochloride Impurity C as Hydrochloride
Show more names
Methadone Hydrochloride EP Impurity C as HydrochlorideControlled Substance(Levomethadone hydrochloride EP Impurity C4-(Dimethylamino)-3-methyl-2,2-diphenylbutanenitrile hydrochloride(3RS)-4-(Dimethyl- amino)-3-methyl-2,2-diphenylbutanenitrile Hydro- chloride (Isodidiavalo Hydrochloride)
Database identifiers
- CAS
63867-26-5- PubChem CID
- 44860
Properties
Computed structural properties
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 335
Chemistry & industry
Suppliers3 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
广州佳途科技股份有限公司020-81960175-877 18933936954 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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