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Anastrozole Dimer Impurity structure, CAS 1216898-82-6

Anastrozole Dimer Impurity

CAS Number1216898-82-6

Synonyms2,3-Bis[3-(2-cyano-2-propanyl)-5-(1H-1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile

Molecular FormulaC30H31N9

Molecular Weight517.627

Purity

Density1.2±0.1 g/cm3

Boiling Point722.1±70.0 °C at 760 mmHg

Melting Point

Flash Point

Appearance

EINECS

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Symbol

Signal Word

Cat. No.: 2A-2174814 Purity:
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Quality Control of [ 1216898-82-6 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number1216898-82-6
Catalog No.2A-2174814
Chinese Name阿那曲唑二聚体杂质
Synonyms2,3-Bis[3-(2-cyano-2-propanyl)-5-(1H-1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile
Molecular FormulaC30H31N9
Molecular Weight517.627
Density1.2±0.1 g/cm3
Boiling Point722.1±70.0 °C at 760 mmHg
PubChem ID162254746
SMILESCC(C)(C#N)c1cc(Cn2cncn2)cc(CC(C)(C#N)c2cc(Cn3cncn3)cc(C(C)(C)C#N)c2)c1
InChIInChI=1S/C30H31N9/c1-28(2,15-31)25-7-22(6-23(8-25)13-38-20-34-18-36-38)12-30(5,17-33)27-10-24(14-39-21-35-19-37-39)9-26(11-27)29(3,4)16-32/h6-11,18-21H,12-14H2,1-5H3
InChI KeyXOBTYKNGXUMRQU-UHFFFAOYSA-N
Transport InfoProduct name: Anastrozole dimer impurity
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