Noracymethadol Hydrochloride
Basic information
- CAS
5633-25-0- Standard SMILES
CCC(OC(C)=O)C(CC(C)NC)(c1ccccc1)c1ccccc1.Cl- InChIKey
QOWPUUFVFLIYRR-UHFFFAOYSA-N- Molecular formula
- C22H30ClNO2
- Average molar mass
- 375.9 g/mol
- Monoisotopic mass
- 375.1965069
Overview
See also: Noracymethadol (has active moiety).
Names & identifiers
- Preferred name
- Noracymethadol Hydrochloride
- IUPAC
- [6-(methylamino)-4,4-diphenylheptan-3-yl] acetate;hydrochloride
- English name
- Noracymethadol
- Molecular formula
- C22H30ClNO2
- Molecular weight
- 375.9321
Names & synonyms
Noracymethadol hydrochlorideNoracymethadol HClNIH 7667Noracymethadol hydrochloride [USAN]5633-25-0UNII-26F8776D91NIH-7667levo-alpha-Noracetylmethadol hydrochloride26F8776D916-(Methylamino)-4,4-diphenyl-3-heptanol acetate (ester) hydrochlorideNoracymethadol hydrochloride (USAN)NORACYMETHADOL HYDROCHLORIDE [MI]
Show more names
QOWPUUFVFLIYRR-UHFFFAOYSA-NNoracymethadol Hydrochloride (1mg/mL in Methanol)
4,4-Diphenyl-6-(methylamino)-3-heptanol acetate, hydrochloridedl-3-Acetoxy-4,4-diphenyl-6-methyl-aminoheptane hydrochlorideBenzeneethanol, alpha-ethyl-beta-(2-(methylamino)propyl)-beta-phenyl-, acetate hydrochloride3-HEPTANOL, 4,4-DIPHENYL-6-(METHYLAMINO)-, ACETATE, HYDROCHLORIDE, (+-)-BENZENEETHANOL, .ALPHA.-ETHYL-.BETA.-(2-(METHYLAMINO)PROPYL)-.BETA.-PHENYL-, ACETATE (ESTER), HYDROCHLORIDEBenzeneethanol, alpha-ethyl-beta-(2-(methylamino)propyl)-beta-phenyl-, acetate (ester), hydrochlorideRefChem:16653530109
Database identifiers
- CAS
5633-25-0- PubChem CID
- 11639413
- DTXSID
DTXSID40971765
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 379
Physicochemical properties
- Melting point
- 216 · ~216-217°
- FDA UNII
- 26 F8776D91 · 26F8776D91
- Toxicity
- 50 oral · LD50 oral in rat: 44mg/kg
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LD50 oral in rat: 44mg/kg
Chemistry & industry
Applications
UsesAnalgesic.
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Related reactions
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Compound notes
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