(6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one

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Names

[ CAS No. ]:
125-58-6

[ Name ]:
(6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one

[Synonym ]:
Levothyl
Levadone
l-Polamivet
Polamivet
l-methadone
L-Polamidon
Levomethadone

Chemical & Physical Properties

[ Density]:
1.009g/cm3

[ Boiling Point ]:
423.7ºC at 760mmHg

[ Melting Point ]:
99-100ºC

[ Molecular Formula ]:
C21H27NO

[ Molecular Weight ]:
309.44500

[ Flash Point ]:
126.5ºC

[ Exact Mass ]:
309.20900

[ PSA ]:
20.31000

[ LogP ]:
4.29200

[ Vapour Pressure ]:
2.2E-07mmHg at 25°C

[ Index of Refraction ]:
1.538

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MJ5990000
CHEMICAL NAME :
3-Heptanone, 6-(dimethylamino)-4,4-diphenyl-, L-
CAS REGISTRY NUMBER :
125-58-6
BEILSTEIN REFERENCE NO. :
3213668
LAST UPDATED :
199612
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C21-H27-N-O
MOLECULAR WEIGHT :
309.49
WISWESSER LINE NOTATION :
2VXR&R&1Y1&N1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
97 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
32 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
26500 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
1600 ug/kg
SEX/DURATION :
male 1 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Paternal Effects - other effects on male

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Rodent - rat Testis
DOSE/DURATION :
50 umol/L
REFERENCE :
BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 27,123,1978

Safety Information

[ HS Code ]:
2922399090

Synthetic Route

Precursor & DownStream

Precursor

  • (+/-)-METHADONE
  • 2,2-Diphenylacetonitrile
  • rac-2-Despropionyl 2-Cyano Methadone (Methadone Nitrile)
  • (R)-(-)-2,2-diphenyl-4-dimethylaminopentanenitrile
  • ETHYLMAGNESIUM BROMIDE

DownStream

Customs

[ HS Code ]: 2922399090

[ Summary ]:
2922399090 other amino-aldehydes, amino-ketones and amino-quinones, other than those containing more than one kind of oxygen function; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%


Related Compounds

  • (6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one,hydrobromide
  • (6R)-6-(Dimethylamino)-4,4-diphenyl-3-heptanone hydrochloride (1: 1)
  • (5S,6R)-6-(dimethylamino)-5-methyl-4,4-diphenylheptan-3-one
  • [(3S,6R)-6-(dimethylamino)-4,4-diphenylheptan-3-yl] acetate
  • 1,1,1-trideuterio-6-(dimethylamino)-4,4-diphenylheptan-3-one
  • β-Methadol Hydrochloride