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129970-98-5

129970-98-5 Structure

129970-98-5 Structure
IdentificationBack Directory
[Name]

(S)-Ethyl 2-((3S,5aS,9aS,10aS)-3-methyl-1,4-dioxodecahydropyrazino[1,2-a]indol-2(1H)-yl)pentanoate ,95%
[CAS]

129970-98-5
[Synonyms]

Perindopril IMpurity F
Perindopril EP IMpurity F
Perindoprilat EP impurity F
Perindopril Diketopiperazine
[3S-[2(R*),3α,5aβ,9aβ,10aβ]]-
Perindopril IMpurity – F (EP)
Perindopril Related CoMpound F
Perindopril USP Related Compound F
Perindopril tert-Butylamine Impurity F
Perindopril tert-Butylamine EP Impurity F
Perindopril Impurity 6(Perindopril EP Impurity F )
Perindopril EP Impurity F/ Perindopril Related Compound F (Perindopril Diketopiperazine)
(S)-Ethyl 2-{(3S,5aS,9aS,10aS)-3-methyl-1,4-dioxodecahydropyrazino[1,2-a]indol-2(1H)-yl}pentanoate
(S)-Ethyl 2-((3S,5aS,9aS,10aS)-3-methyl-1,4-dioxodecahydropyrazino[1,2-a]indol-2(1H)-yl)pentanoate ,95%
(αS,3S,5aS,9aS,10aS)-Decahydro-3-Methyl-1,4-dioxo-α-propylpyrazino[1,2-a]indole-2(1H)-acetic Acid Ethyl Ester
Perindopril Related Compound F ((S)-ethyl 2-{(3S,5aS,9aS,10aS)-3-methyl-1,4-dioxodecahydropyrazino[ (1510947)
Pyrazino[1,2-a]indole-2(1H)-acetic acid, decahydro-3-methyl-1,4-dioxo-α-propyl-, ethyl ester, (αS,3S,5aS,9aS,10aS)-
(alphaS,3S,5aS,9aS,10aS)-Decahydro-3-methyl-1,4-dioxo-alpha-propylpyrazino[1,2-a]indole-2(1H)-acetic acid ethyl ester
ethyl (2S)-2-[(3S,5aS,9aS,10aS)-3-methyl-1,4-dioxo-5a,6,7,8,9,9a,10,10a-octahydro-3H-pyrazino[1,2-a]indol-2-yl]pentanoate
Perindopril Related Compound F (10 mg) ((S)-ethyl 2-{(3S,5aS,9aS,10aS)-3-methyl-1,4-dioxodecahydropyrazino[1,2-a]indol-2(1H)-yl}pentanoate)
[Molecular Formula]

C19H30N2O4
[MDL Number]

MFCD26967878
[MOL File]

129970-98-5.mol
[Molecular Weight]

350.45
Chemical PropertiesBack Directory
[Melting point ]

98-101°C
[Boiling point ]

526.1±50.0 °C(Predicted)
[density ]

1.17±0.1 g/cm3(Predicted)
[storage temp. ]

-20°C Freezer
[solubility ]

Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Sparingly)
[form ]

Solid
[pka]

-1.15±0.40(Predicted)
[color ]

White to Off-White
[Major Application]

pharmaceutical (small molecule)
[InChI]

1S/C19H30N2O4/c1-4-8-15(19(24)25-5-2)20-12(3)17(22)21-14-10-7-6-9-13(14)11-16(21)18(20)23/h12-16H,4-11H2,1-3H3/t12-,13-,14-,15-,16-/m0/s1
[InChIKey]

BSZZSBSELAVBAG-QXKUPLGCSA-N
[SMILES]

N21[C@@H]3[C@H](C[C@H]2C(=O)N([C@H](C1=O)C)[C@@H](CCC)C(=O)OCC)CCCC3
Safety DataBack Directory
[WGK Germany ]

WGK 3
[HS Code ]

2933999552
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

White Solid
[Uses]

Perindopril Diketopiperazine (Perindopril EP Impurity F) is an impurity of Perindopril (P287500).
[Uses]

Perindopril Diketopiperazine is an impurity of Perindopril (P287500).
Spectrum DetailBack Directory
[Spectrum Detail]

(S)-Ethyl 2-((3S,5aS,9aS,10aS)-3-methyl-1,4-dioxodecahydropyrazino[1,2-a]indol-2(1H)-yl)pentanoate ,95%(129970-98-5)1HNMR
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