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Canertinib dihydrochloride structure, CAS 289499-45-2

Canertinib dihydrochloride

CAS Number289499-45-2

SynonymsCanertinib dihydrochloride; Canertinib HCl; CI103; Canertinib (dihydrochloride)

Molecular FormulaC24H27Cl3FN5O3

Molecular Weight558.86

Purity≥98 (HPLC)%

Density1.355g/cm3

Boiling Point691ºC at 760mmHg

Melting Point188-190℃

Flash Point

Appearancesolid

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9056356 Purity: ≥98 (HPLC)%
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Quality Control of [ 289499-45-2 ] Purity: ≥98 (HPLC)% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number289499-45-2
Catalog No.2A-9056356
Chinese Name卡纽替尼二盐酸盐
SynonymsCanertinib dihydrochloride; Canertinib HCl; CI103; Canertinib (dihydrochloride)
Molecular FormulaC24H27Cl3FN5O3
Molecular Weight558.86
Purity≥98 (HPLC)
Density1.355g/cm3
Boiling Point691ºC at 760mmHg
Melting Point188-190℃
Appearancesolid
Water SolubilityDMSO: >10mg/mL
Storage Condition?20°C
ApplicationCanertinib dihydrochloride (CI-1033; PD-183805) is a potent, irreversible EGFR inhibitor; inhibiting cellular EGFR and ErbB2 autophosphorylation with IC50 values ​​of 7.4 and 9 nM, respectively.
PubChem ID329775143
MDL NumberMFCD09954112
SMILESCl.Cl.Fc1ccc(Nc2ncnc3cc(OCCCN4CCOCC4)c(NC(=O)C=C)cc23)cc1Cl
InChI1S/C24H25ClFN5O3.2ClH/c1-2-23(32)30-21-13-17-20(14-22(21)34-9-3-6-31-7-10-33-11-8-31)27-15-28-24(17)29-16-4-5-19(26)18(25)12-16;;/h2,4-5,12-15H,1,3,6-11H2,(H,30,32)(H,27,28,29);2*1H
InChI KeyJZZFDCXSFTVOJY-UHFFFAOYSA-N
NACRES CodeNA.77
UNSPSC51111800
MSDSmsds/56356_1_289499_45_2.pdf
Transport InfoProduct Name: Canertinib dihydrochloride
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