Product Code

TRC-I778820

CAS Number

1338800-82-0

Product Format

Neat

Molecular Formula

C17H20N4O2

Molecular Weight

312.37

Product Categories

TRC

Product Type

Impurity

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Isoanastrozole Mono Acid

CAS Number

1338800-82-0

Molecular Formula

C17H20N4O2

Molecular Weight

312.37

Accurate Mass

312.16

SMILES

OC(C(C)(C)C1=CC(CN2C=NN=C2)=CC(C(C)(C)C#N)=C1)=O

InChI

InChI=1S/C17H20N4O2/c1-16(2,9-18)13-5-12(8-21-10-19-20-11-21)6-14(7-13)17(3,4)15(22)23/h5-7,10-11H,8H2,1-4H3,(H,22,23)

IUPAC

2-(3-((4H-1,2,4-triazol-4-yl)methyl)-5-(2-cyanopropan-2-yl)phenyl)-2-methylpropanoic acid

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Isoanastrozole Mono Acid

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