Noracymethadol hydrochloride, (-)-
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Basic information
- CAS
55096-75-8- Standard SMILES
CC[C@H](OC(C)=O)C(C[C@H](C)NC)(c1ccccc1)c1ccccc1.Cl- InChIKey
QOWPUUFVFLIYRR-PVMVIUQGSA-N- Molecular formula
- C22H30ClNO2
- Average molar mass
- 375.9 g/mol
- Monoisotopic mass
- 375.1965069
Names & identifiers
- Preferred name
- Noracymethadol hydrochloride, (-)-
- IUPAC
- [(3S,6S)-6-(methylamino)-4,4-diphenylheptan-3-yl] acetate;hydrochloride
- English name
- L-α-NoracetylMethadol Hydrochloride
- Molecular formula
- C22H29NO2.ClH
- Molecular weight
- 375.93
Names & synonyms
55096-75-8Noracymethadol hydrochloride, (-)-1BLK12VUOXDTXSID5048920(-)-a-Noracetylmethadol Hydrochloride(-)-Alpha-Noracetylmethadol Hydrochloride (1.0mg/ml in Acetonitrile)UNII-1BLK12VUOXalpha-Acetyl-N-normethadol hydrochloride, L-(-)-noracymethadol hydrochlorideNORACYMETHADOL HYDROCHLORIDE, L-(S-(R*,R*))-alpha-Ethyl-beta-(2-(methylamino)propyl)-beta-phenylbenzeneethanol acetate (ester), hydrochlorideBenzeneethanol, alpha-ethyl-beta-(2-(methylamino)propyl)-beta-phenyl-, acetate (ester), hydrochloride, (S-(R*,R*))-
Show more names
α-d-NoracetylMethadoll-α-AcetylnorMethadol HydrochlorideL-α-NoracetylMethadol Hydrochloride(-)-α-NoracetylMethadol HydrochlorideL-α-Acetyl-N-norMethadol Hydrochloride(-)-Alpha-Noracetylmethadol Hydrochloride(αS)-α-Ethyl-β-[(2S)-2-(MethylaMino)propyl]-β-phenylbenzeneethanol Acetate (Ester) Hydrochloride[R-(R*,R*)]-α-ethyl-β-[2-(MethylaMino)propyl]-β-phenylbenzeneethanol Acetate (Ester) Hydrochloride[S-(R*,R*)]-α-Ethyl-β-[2-(MethylaMino)propyl]-β-phenylbenzeneethanol Acetate (Ester) Hydrochloride
L-alphalpha-Noracetylmethadol hydrochlorideL-I+/-lpha-Noracetylmethadol hydrochlorideL-.ALPHA.-ACETYLNORMETHADOL HYDROCHLORIDEQ27252202(3S,6S)-6-(Methylamino)-4,4-diphenylheptan-3-yl acetate--hydrogen chloride (1/1)BENZENEETHANOL, .ALPHA.-ETHYL-.BETA.-(2-(METHYLAMINO)PROPYL)-.BETA.-PHENYL-, ACETATE (ESTER), HYDROCHLORIDE, (S-(R*,R*))-
Database identifiers
- CAS
55096-75-8- PubChem CID
- 135259
- DTXSID
DTXSID5048920- UNII
- 1BLK12VUOX
- EC Number
- 809-343-8
Properties
Computed structural propertiesFilling in
- 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
- FDA UNII
- 1 BLK12VUOX · 1BLK12VUOX
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 302 · H302-H410
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P273-P391-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H302-H410
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P273-P391-P501
Chemistry & industry
Applications
UsesAn active N-demethylated metabolite of the μ-opioid receptor agonist L-α-Acetylmethadol (A186325).
UsesAn active N-demethylated metabolite of the μ-opioid receptor agonist (-)-α-Acetylmethadol (A186325).
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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