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1378388-16-9

1378388-16-9 Structure

1378388-16-9 Structure
IdentificationBack Directory
[Name]

(2S,4S)-1-(tert-butoxycarbonyl)-4-(MethoxyMethyl)pyrrolidine-2-carboxylic acid
[CAS]

1378388-16-9
[Synonyms]

GS-5816 interMediate
Velpatasvir Impurity 5
Velpatasvir Intermediate 3
Velpatasvir Intermediate-I SS-Isomer
Velpatasvir intermediate II- SS isomer
(2S,4S)-4-(Methoxymethyl)-1,2-pyrrolidine
(2S,4S)-1-(tert-butoxycarbonyl)-4-(MethoxyMethyl)
N-Tert-Butoxycarbonyl-(4S)-4-Methoxymethyl-L-proline
(2s,4s)-4-(methoxymethyl)-1,2-pyrrolidinedicarboxylic acid
(2S,4S)-1-(tert-butoxycarbonyl)-4-(MethoxyMethyl)pyrrolidine...
3-(2-bromoacetyl)-10,11-dihydro-5H-dibenzo[c,g]chromen-8(9H)-one
(2 S,4S)-4-(methoxy methyl)-1,2-pyrrolidine dimethyl acid 1-tert-butyl ester
(2S,4S)-1-(tert-butoxycarbonyl)-4-(MethoxyMethyl)pyrrolidine-2-carboxylic acid
(2S,4S)-4-(methoxymethyl)-1, 2-pyrrolidine dicarboxylic acid, 1-tert-butyl ester
(2S, 4S) -1- (tert butoxycarbonyl) -4- (methoxymethyl) pyrroline-2-carboxylic acid
(2S,4S)-4-(Methoxymethyl)-1,2-pyrrolidinedicarboxylic acid 1-(1,1-dimethylethyl) ester
1,2-Pyrrolidinedicarboxylic acid, 4-(methoxymethyl)-, 1-(1,1-dimethylethyl) ester, (2S,4S)-
[EINECS(EC#)]

807-416-9
[Molecular Formula]

C12H21NO5
[MDL Number]

MFCD29035280
[MOL File]

1378388-16-9.mol
[Molecular Weight]

259.299
Chemical PropertiesBack Directory
[Boiling point ]

371.2±27.0 °C(Predicted)
[density ]

1.162±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,2-8°C
[form ]

Solid
[pka]

3.91±0.40(Predicted)
[color ]

White to off-white
[Optical Rotation]

Consistent with structure
[Water Solubility ]

12.2g/L
[InChI]

InChI=1S/C12H21NO5/c1-12(2,3)18-11(16)13-6-8(7-17-4)5-9(13)10(14)15/h8-9H,5-7H2,1-4H3,(H,14,15)/t8-,9-/m0/s1
[InChIKey]

OHPUCEUCBHBIAW-IUCAKERBSA-N
[SMILES]

N1(C(OC(C)(C)C)=O)C[C@@H](COC)C[C@H]1C(O)=O
[LogP]

1.16
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H317
[Precautionary statements ]

P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
[REACH Registrations]

Active
Hazard InformationBack Directory
[Uses]

(2S,4S)-1-(tert-Butoxycarbonyl)-4-(methoxymethyl)pyrrolidine-2-carboxylic Acid is an antiviral agent and Velpatasvir (V116000) intermediate. Velpatasvir is a NS5A inhibitor in patients with hepatitis C (HCV) infection.
Spectrum DetailBack Directory
[Spectrum Detail]

(2S,4S)-1-(tert-butoxycarbonyl)-4-(MethoxyMethyl)pyrrolidine-2-carboxylic acid(1378388-16-9)1HNMR
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