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Levomethadyl acetate hydrochloride

HCID 39371
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
43033-72-3
Standard SMILES
CC[C@H](OC(C)=O)C(C[C@H](C)N(C)C)(c1ccccc1)c1ccccc1.Cl
InChIKey
UXBPQRGCVJOTNT-COBSGTNCSA-N
Molecular formula
C23H32ClNO2
Average molar mass
390 g/mol
Monoisotopic mass
389.212157

Overview

Levomethadyl acetate hydrochloride is a diarylmethane.

Names & identifiers

Preferred name
Levomethadyl acetate hydrochloride
IUPAC
[(3S,6S)-6-(dimethylamino)-4,4-diphenylheptan-3-yl] acetate;hydrochloride
English name
Levomethadyl acetate hydrochloride
Molecular formula
C23H31NO2.ClH
Molecular weight
389.96

Names & synonyms

Levomethadyl acetate hydrochloride43033-72-3Levomethadyl acetate HClLAAM hydrochloridel-alpha-Acetylmethadol hydrochlorideLevomethadyl acetate hydrochloride [USAN]MK790B54CW5KG52MK-790(-)-(3S,6S)-6-(Dimethylamino)-4,4-diphenyl-3-heptanol acetate (ester), hydrochloride(-)-alpha-Acetylmethadol Hydrochloride[(3S,6S)-6-(dimethylamino)-4,4-diphenylheptan-3-yl] acetate;hydrochloride
Show more names
MK 790LAAM:HCLORLAAM hydrochlorideMK-790 hydrochlorideMethadyl acetate hydrochloridel-α-Acetylmethadol hydrochloride(-)-Acetylmethadol hydrochloride
(-)-a-Acetylmethadol Hydrochloride (1.0mg/ml in Acetonitrile)l-Acetylmethadol hydrochlorideLevomethadyl acetate hydrochloride (USAN)(-)-a-Acetylmethadol HydrochlorideCCRIS 3321Levacetyl methadol hydrochlorideLAAM-HClalpha-l-Acetylmethadol hydrochloride

Properties

Computed structural properties

Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
9
Heavy atoms
27
Formal charge
0
Complexity
404

Experimental & physicochemical properties

Human Drugs · 2 items

FDA approved drugs -> Active ingredient

FDA approved drugs -> Active ingredient

Physicochemical properties

Melting point
215 ° · 215°
alpha
25 · D25 -60° (c = 0.2)
storage temp.
2 · 2-8°C
solubility
2 O: · H2O: >5mg/mL
color
white
FDA UNII
54 CW5KG52 · B54CW5KG52
Symbol(GHS)
6 · GHS06
Signal word
Danger
Hazard statements
300 · H300-H315-H319-H335-H413
Precautionary statements
261 · P261-P264-P301+P310-P305+P351+P338
Hazard Codes
T
Risk Statements
25 · 25-36/37/38
Safety Statements
26 · 26-45

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 · 4 items

Danger

H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 2 (100%)

Safety data

rtecs
MJ3680000
ridadr
UN 2811 6.1 / PGII
Toxicity
LD50 in mice (mg/kg): 110.0 s.c., 172.8 orally (Eddy)
risk_code
25-36/37/38
Signal word
Danger
Symbol(GHS)
GHS06
hazard_code
T
safety_code
26-45
Hazard statements
H300-H315-H319-H335-H413
Precautionary statements
P261-P264-P301+P310-P305+P351+P338

Chemistry & industry

Applications

UsesAnalgesic (narcotic).

Additional notes

DefinitionChEBI: Levomethadyl acetate hydrochloride is a diarylmethane.

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
43033-72-3
PubChem CID
39371
DTXSID
DTXSID7020500
ChEMBL
CHEMBL1200817
ChEBI
CHEBI:6442
UNII
B54CW5KG52
EC Number
636-969-7
RIDADR
2811 · UN 2811 6.1 / PGII
RTECS
3680000 · MJ3680000
Toxicity
50 in · LD50 in mice (mg/kg): 110.0 s.c., 172.8 orally (Eddy)