AG01EORX

Name: d-Atabrine dihydrochloride
Brand: Angene Chemical
SKU: AG01EORX

56100-41-5 | d-Atabrine dihydrochloride

AG01EORX

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COA

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WARNING This product is not for human or veterinary use.

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CAS Number	56100-41-5
Catalog Number	AG01EORX(AGN-PC-0SKBR0)
Chemical Name	d-Atabrine dihydrochloride
IUPAC Name	(4S)-4-N-(6-chloro-2-methoxyacridin-9-yl)-1-N,1-N-diethylpentane-1,4-diamine;dihydrochloride
InChI	InChI=1S/C23H30ClN3O.2ClH/c1-5-27(6-2)13-7-8-16(3)25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(28-4)15-20(21)23;;/h9-12,14-16H,5-8,13H2,1-4H3,(H,25,26);2*1H/t16-;;/m0../s1
InChI Key	UDKVBVICMUEIKS-SQKCAUCHSA-N
MDL Number	MFCD31630800
Molecular Formula	C23H32Cl3N3O
Molecular Weight	472.8787
SMILES	C(N(CC)CC)CC[C@@H](NC1=C2C=C(OC)C=CC2=NC2C1=CC=C(Cl)C=2)C.Cl.Cl
Synonyms	d-Atabrine dihydrochloride, d-Atabrine 2HCl, 56100-41-5, HY-13735D, CS-0040942, UNII-81A613ZZ6X component UDKVBVICMUEIKS-SQKCAUCHSA-N,

Complexity	461
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	471.161096g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	472.9g/mol
Monoisotopic Mass	471.161096g/mol
Rotatable Bond Count	9
Topological Polar Surface Area	37.4Å²
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited