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trans-CLOMIPHENE CITRATE
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Name

trans-CLOMIPHENE CITRATE

 EINECS N/A
CAS No. 7599-79-3 Density g/cm3
PSA 144.60000 LogP 5.31410
Solubility N/A Melting Point 143-145°C
Formula C26H28ClNO•C6H8O7 Boiling Point 509°Cat760mmHg
Molecular Weight 598.093 Flash Point 261.6°C
Transport Information N/A Appearance N/A
Safety An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits very toxic fumes of Cl− and NOx. Risk Codes N/A
Molecular Structure Molecular Structure of 7599-79-3 (trans-clomifene citrate) Hazard Symbols N/A
Synonyms

N/A

Article Data 3

trans-CLOMIPHENE CITRATE Synthetic route

ethanamine, 2-[4-[(1E)-2-chloro-1,2-diphenyl ethenyl]phenoxy]-N,N-diethyl-, (±)-1,1‘-binaphthyl-2,2’-diylhydrogenphosphate

77-92-9

citric acid

7599-79-3

clomiphene citrate

Conditions
ConditionsYield
Stage #1: ethanamine, 2-[4-[(1E)-2-chloro-1,2-diphenyl ethenyl]phenoxy]-N,N-diethyl-, (±)-1,1‘-binaphthyl-2,2’-diylhydrogenphosphate With sodium hydroxide In water; toluene at 20℃; for 2h;
Stage #2: citric acid In acetone at 0 - 50℃; for 2h;		97.07 g
Stage #1: ethanamine, 2-[4-[(1E)-2-chloro-1,2-diphenyl ethenyl]phenoxy]-N,N-diethyl-, (±)-1,1‘-binaphthyl-2,2’-diylhydrogenphosphate With ammonia In ethyl acetate
Stage #2: citric acid In ethanol; ethyl acetate at 20℃; for 1h;
Stage #1: ethanamine, 2-[4-[(1E)-2-chloro-1,2-diphenyl ethenyl]phenoxy]-N,N-diethyl-, (±)-1,1‘-binaphthyl-2,2’-diylhydrogenphosphate With ammonium hydroxide In tert-butyl methyl ether; water; isopropyl alcohol for 1h;
Stage #2: citric acid In ethanol; water at 60 - 65℃;		269 g

1-{4-[2-(diethylamino)ethoxy]phenyl}-1,2-diphenylethanol

7599-79-3

clomiphene citrate

Conditions
ConditionsYield
Multi-step reaction with 4 steps
1.1: hydrogenchloride / toluene / Dean-Stark; Reflux
2.1: acetic acid; 1,3-dichloro-5,5-dimethylhydantoin / toluene / 2 h / 60 °C
2.2: 4.5 h / 0 °C / Heating
3.1: methanol / 1 h / 20 - 45 °C
4.1: sodium hydroxide / toluene; water / 2 h / 20 °C
4.2: 2 h / 0 - 50 °C
View Scheme
50-41-9

clomifene citrate

7599-79-3

clomiphene citrate

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1.1: methanol / 1 h / 20 - 45 °C
2.1: sodium hydroxide / toluene; water / 2 h / 20 °C
2.2: 2 h / 0 - 50 °C
View Scheme
19957-52-9

2-{4-(1,2-diphenylethenyl)phenoxy}-N,N-diethylethanamine hydrochloride

7599-79-3

clomiphene citrate

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1.1: acetic acid; 1,3-dichloro-5,5-dimethylhydantoin / toluene / 2 h / 60 °C
1.2: 4.5 h / 0 °C / Heating
2.1: methanol / 1 h / 20 - 45 °C
3.1: sodium hydroxide / toluene; water / 2 h / 20 °C
3.2: 2 h / 0 - 50 °C
View Scheme
73404-00-9

1-{4-[2-(diethylamino)ethoxy]phenyl}-1,2-diphenylethanol

7599-79-3

clomiphene citrate

Conditions
ConditionsYield
Multi-step reaction with 4 steps
1.1: sulfuric acid / dichloromethane / 1 h / 0 - 20 °C
2.1: N-chloro-succinimide / dichloromethane / 32 h / 20 °C
2.2: 0.5 h / 20 °C / pH 8 - 9
3.1: methanol / 2 h / 20 °C
4.1: ammonia / ethyl acetate
4.2: 1 h / 20 °C
View Scheme
911-45-5

clomiphene

7599-79-3

clomiphene citrate

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1.1: methanol / 2 h / 20 °C
2.1: ammonia / ethyl acetate
2.2: 1 h / 20 °C
View Scheme

2-{4-[(Z)-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanaminium hydrogen sulfate

7599-79-3

clomiphene citrate

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1.1: N-chloro-succinimide / dichloromethane / 32 h / 20 °C
1.2: 0.5 h / 20 °C / pH 8 - 9
2.1: methanol / 2 h / 20 °C
3.1: ammonia / ethyl acetate
3.2: 1 h / 20 °C
View Scheme
911-45-5, 15690-55-8, 15690-57-0

clomiphene

77-92-9

citric acid

7599-79-3

clomiphene citrate

Conditions
ConditionsYield
In ethanol; water at 65℃; Solvent;20.2 g
7599-79-3

clomiphene citrate

911-45-5, 15690-55-8, 15690-57-0

clomiphene

Conditions
ConditionsYield
With sodium hydroxide In ethyl acetate for 0.5h;99%
7599-79-3

clomiphene citrate

(Z)-N,N-diethyl-2-(4-(5-(oxiran-2-ylmethoxy)-1,2-diphenylpent-1-en-1-yl)phenoxy)ethan-1-amine

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1.1: sodium hydroxide / ethyl acetate / 0.5 h
2.1: tert.-butyl lithium / pentane; tetrahydrofuran / 18.5 h / -40 - 20 °C
3.1: tetrabutylammomium bromide; sodium hydroxide
3.2: 15 h / 20 °C
View Scheme

trans-CLOMIPHENE CITRATE Chemical Properties

The molecular formula of trans-CLOMIPHENE CITRATE (7599-79-3) is C32H36ClNO8  and its formula weight is 598.14 g/mol.The boiling point is 509°C at 760mmHg.Enthalpy of vaporization is 77.94 kJ/mol.Its flash point is  261.6°C and the vapor pressenge is 1.77E-10 mmHg at 25°C .The chemical synonyms of trans-CLOMIPHENE CITRATE (7599-79-3) are trans-clomifene citrate .The molecular structure of trans-CLOMIPHENE CITRATE (7599-79-3) is  .

trans-CLOMIPHENE CITRATE Safety Profile

An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits very toxic fumes of Cl− and NOx.

trans-CLOMIPHENE CITRATE Specification

Its extinguishing agent is sand, dry powder and foam.
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