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(S)-Sitagliptin Phosphate structure, CAS 823817-58-9

(S)-Sitagliptin Phosphate

CAS Number823817-58-9

SynonymsExact Mass 505.09500; PSA 174.78000; LogP 3.21860; InChIKey IQFYVLUXQXSJJN-PSLXZBMDSA-N; Precursor & DownStream; Precursor 0; DownStream 1; CAS#:486460-32-6; Sitagliptin; Synonyms

Molecular FormulaC16H16F6N5O5P

Molecular Weight505.30900

Purity98.00%

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Cat. No.: 2A-1166546 Purity: 98.00%
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Quality Control of [ 823817-58-9 ] Purity: 98.00% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number823817-58-9
Catalog No.2A-1166546
Chinese Name西他列汀(S)-异构体磷酸盐
SynonymsExact Mass 505.09500; PSA 174.78000; LogP 3.21860; InChIKey IQFYVLUXQXSJJN-PSLXZBMDSA-N; Precursor & DownStream; Precursor 0; DownStream 1; CAS#:486460-32-6; Sitagliptin; Synonyms
Molecular FormulaC16H16F6N5O5P
Molecular Weight505.30900
Purity98.00
PubChem ID16529520
SMILESNC(CC(=O)N1CCn2c(nnc2C(F)(F)F)C1)Cc1cc(F)c(F)cc1F.O=P(O)(O)O
InChIInChI=1S/C16H15F6N5O.H3O4P/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22;1-5(2,3)4/h4,6,9H,1-3,5,7,23H2;(H3,1,2,3,4)/t9-;/m0./s1
InChI KeyIQFYVLUXQXSJJN-PSLXZBMDSA-N
Transport InfoProduct name: ent-Sitagliptin Phosphate
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