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Product Code

TRC-L473300

CAS Number

945976-43-2

Product Format

Neat

Molecular Formula

C27 H22 F4 N4 O3

Molecular Weight

526.482

Product Type

Synthesis Tools

Price and availability

48-hour USA dispatch time
Freight restricted.

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Product Information

Chemical Data

Analyte Name

LP 533401

CAS Number

945976-43-2

Molecular Formula

C27 H22 F4 N4 O3

Molecular Weight

526.482

Accurate Mass

526.163

SMILES

N[C@@H](Cc1ccc(cc1)c2cc(OC(c3ccc(cc3)c4cccc(F)c4)C(F)(F)F)nc(N)n2)C(=O)O

InChI

InChI=1S/C27H22F4N4O3/c28-20-3-1-2-19(13-20)16-8-10-18(11-9-16)24(27(29,30)31)38-23-14-22(34-26(33)35-23)17-6-4-15(5-7-17)12-21(32)25(36)37/h1-11,13-14,21,24H,12,32H2,(H,36,37)(H2,33,34,35)/t21-,24?/m0/s1

IUPAC

(2S)-2-amino-3-[4-[2-amino-6-[2,2,2-trifluoro-1-[4-(3-fluorophenyl)phenyl]ethoxy]pyrimidin-4-yl]phenyl]propanoic acid

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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