Home Carboxys ethyl 1-(2-aminoethyl)-1H-imidazole-4-carboxylate dihydrochloride

ethyl 1-(2-aminoethyl)-1H-imidazole-4-carboxylate dihydrochloride

CAS No.:
1787868-42-1
Catalog Number:
AG01BGRN
Molecular Formula:
C8H15Cl2N3O2
Molecular Weight:
256.1296
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Product Description
Catalog Number:
AG01BGRN
Chemical Name:
ethyl 1-(2-aminoethyl)-1H-imidazole-4-carboxylate dihydrochloride
CAS Number:
1787868-42-1
Molecular Formula:
C8H15Cl2N3O2
Molecular Weight:
256.1296
MDL Number:
MFCD28125230
IUPAC Name:
ethyl 1-(2-aminoethyl)imidazole-4-carboxylate;dihydrochloride
InChI:
InChI=1S/C8H13N3O2.2ClH/c1-2-13-8(12)7-5-11(4-3-9)6-10-7;;/h5-6H,2-4,9H2,1H3;2*1H
InChI Key:
NBTDNRLSXNPCDZ-UHFFFAOYSA-N
SMILES:
NCCn1cnc(c1)C(=O)OCC.Cl.Cl
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.054g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
256.127g/mol
Monoisotopic Mass:
255.054g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties