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Home Halogens methyl 2-(3,4-dichlorophenyl)-2-{[2-(dimethylamino)ethyl]amino}acetate dihydrochloride

methyl 2-(3,4-dichlorophenyl)-2-{[2-(dimethylamino)ethyl]amino}acetate dihydrochloride

CAS No.:
1311313-67-3
Catalog Number:
AG01A80C
Molecular Formula:
C13H20Cl4N2O2
Molecular Weight:
378.1221
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Product Description
Catalog Number:
AG01A80C
Chemical Name:
methyl 2-(3,4-dichlorophenyl)-2-{[2-(dimethylamino)ethyl]amino}acetate dihydrochloride
CAS Number:
1311313-67-3
Molecular Formula:
C13H20Cl4N2O2
Molecular Weight:
378.1221
MDL Number:
MFCD15209588
IUPAC Name:
methyl 2-(3,4-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]acetate;dihydrochloride
InChI:
InChI=1S/C13H18Cl2N2O2.2ClH/c1-17(2)7-6-16-12(13(18)19-3)9-4-5-10(14)11(15)8-9;;/h4-5,8,12,16H,6-7H2,1-3H3;2*1H
InChI Key:
KMDIRTKKHFWRPD-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1ccc(c(c1)Cl)Cl)NCCN(C)C.Cl.Cl
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.025g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
378.115g/mol
Monoisotopic Mass:
376.028g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties