Structure of (2S)-2-Amino-4-methyl-1-[(2R)-2-methyloxiranyl]-1-pentanone trifluoroacetate CAS 247068-85-5

Iden­ti­fi­ca­tion

CAS Number

247068-85-5

Name

(2S)-2-Amino-4-methyl-1-[(2R)-2-methyloxiranyl]-1-pentanone tri­flu­o­roac­etate

Syn­onyms

(2S)-2-Amino-4-methyl-1-[(2R)-2-methyl-2-oxiranyl]-1-pentanone tri­flu­o­roac­etate (1:1) [ACD/IUPAC Name]
(2S)-4-Methyl-1-[(2R)-2-methyl-2-oxiranyl]-1-oxo-2-pentanaminium tri­flu­o­roac­etate [ACD/IUPAC Name]
(2S)-4-Methyl-1-[(2R)-2-methyl-2-oxiranyl]-1-oxo-2-pentanaminiumtrifluoracetat [Ger­man] [ACD/IUPAC Name]
1-Pen­­tanone, 2-amino-4-methyl-1-[(2R)-2-methyl-2-oxi­ranyl]-, (2S)-, 2,2,2-trifluoroacetate (1:1)
247068-85-5 [RN]
Acetic acid, 2,2,2-trifluoro-, com­pd. with (2S)-2-amino-4-methyl-1-[(2R)-2-methyloxiranyl]-1-pentanone (1:1) [ACD/​Index Name]
Acide tri­flu­o­roacé­tique – (2S)-2-amino-4-méthyl-1-[(2R)-2-méthyl-2-oxiranyl]-1-pentanone (1:1) [French] [ACD/IUPAC Name]
Tri­flu­o­res­sigsäure –(2S)-2-amino-4-methyl-1-[(2R)-2-methyl-2-oxiranyl]-1-pentanon (1:1) [Ger­man] [ACD/IUPAC Name]
Tri­flu­o­roacé­tate de (2S)-4-méthyl-1-[(2R)-2-méthyl-2-oxiranyl]-1-oxo-2-pentanaminium [French] [ACD/IUPAC Name]
(2S)-2-AMINO-4-METHYL-1-[(2R)-2-METHY­LOXI­RAN-2-YL]PEN­TAN-1-ONE ; TRI­FLU­O­ROACETIC ACID
(2S)-2-Amino-4-methyl-1-[(2R)-2-methyloxiranyl]-1-pentanone tri­flu­o­roac­etate
(2s)-2-amino-4-methyl-1-[(2r)-2-methyloxiranyl]-1-pentanone tri­flu­o­roac­etat
(2s)-2-amino-4-methyl-1-[(2r)-2-methyloxiranyl]-1-pentanone??trifluoroacetat
(2s)-2-amino-4-methyl-1-[(2r)-2-methyloxiranyl]-1-pentanonetrifluoroacetat
(2s)-2-amino-4-methyl-1-[(2r)-2-methyloxiranyl]-1-pentanonetrifluoroacetate
(S)-2-amino-4-methyl-1-((R)-2-methyloxiran-2-yl)pentan-1-one 2,2,2-trifluoroacetate
1-​pen­­tanone, 2-​amino-​4-​methyl-​1-​[(2r)​-​2-​methyl-​2-​oxiranyl]​-​, (2s)​-​, 2,​2,​2-​trifluoroacetate (1:1)
1-???pentanone, 2-???amino-???4-???methyl-???1-???[(2r)???-???2-???methyl-???2-???oxiranyl]???-???, (2s)???-???, 2,???2,???2-???trifluoroacetate (1:1)
1-PEN­­TANONE, 2-AMINO-4-METHYL-1-[(2R)-2-METHY­LOXI­RANYL]-, (2S)-, TRI­FLU­O­ROAC­ETATE
1-Pen­­tanone, 2-aMino-4-Methyl-1-[(2R)-2-Methy­loxi­ranyl]-, (2S)-, tri­flu­o­roac­etate (9CI)
1-Pen­­tanone, 2-amino-4-methyl-1-[(2R)-2-methy­loxi­ranyl]-, (2S)-,tri­flu­o­roac­etate
DS-8695
MFCD28100284
n-[(1s)-3-methyl-1-[[(2r)-2-methyl-2-oxiranyl]carbonyl]butyl]-carbamic acid, 1,1-dimethylethyl ester

SMILES

CC(C)C[C@@H](C(=O)[C@]1(CO1)C)N.C(=O)(C(F)(F)F)O

Std­InChI

InChI=1S/C9H17NO2.C2HF3O2/c1-6(2)4-7(10)8(11)9(3)5-12-9;3-2(4,5)1(6)7/h6-7H,4-5,10H2,1-3H3;(H,6,7)/t7-,9+;/m0./s1

Std­InChIKey

OWG­GQBZQMQM­P­BI-DKXTVVGF­SA-N

Mol­e­c­u­lar Formula

C11H18F3NO4

Mol­e­c­u­lar Weight

285.26

MDL Number

MFCD28100284

Prop­er­ties

Appear­ance

White sol­id

Safe­ty Data

RIDADR 

NONH for all modes of transport

WGK Germany

3

Spec­i­fi­ca­tions and Oth­er Infor­ma­tion of Our (2S)-2-Amino-4-methyl-1-[(2R)-2-methyloxiranyl]-1-pentanone tri­flu­o­roac­etate CAS 247068-85-5

Iden­ti­fi­ca­tion Methods

HPLC

Puri­ty

99% min

RR

≤0.1%

SS

≤0.1%

Water

≤0.5%

Residue on Ignition

≤2%

Sin­gle Impurity

≤0.1%

n-hep­­­tane

≤0.5%

Dichloromethane

≤0.5%

Methyl tert-butyl ether

≤0.5%

Shelf Life

2 years

Stor­age

Under room tem­per­a­ture away from light

Known Appli­ca­tion

Used in Inter­me­di­ates of Carfilzomib

Gen­er­al View of Documents

HPLC of (2S)-2-Amino-4-methyl-1-[(2R)-2-methyloxiranyl]-1-pentanone trifluoroacetate CAS 247068-85-5
HPLC of (2S)-2-Amino-4-methyl-1-[(2R)-2-methyloxiranyl]-1-pentanone tri­flu­o­roac­etate CAS 247068-85-5

This prod­uct is devel­oped by our R&D com­pa­ny Cam­ing Phar­ma­ceu­ti­cal Ltd (https://​www​.cam​ing​.com/).

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