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6481-48-7

6481-48-7 | 2-(1-Methyl-1H-imidazol-4-yl)ethanamine dihydrochloride

CAS No: 6481-48-7 Catalog No: AG0038KD MDL No:MFCD00037000

Product Description

Catalog Number:
AG0038KD
Chemical Name:
2-(1-Methyl-1H-imidazol-4-yl)ethanamine dihydrochloride
CAS Number:
6481-48-7
Molecular Formula:
C6H13Cl2N3
Molecular Weight:
198.0935
MDL Number:
MFCD00037000
IUPAC Name:
2-(1-methylimidazol-4-yl)ethanamine;dihydrochloride
InChI:
InChI=1S/C6H11N3.2ClH/c1-9-4-6(2-3-7)8-5-9;;/h4-5H,2-3,7H2,1H3;2*1H
InChI Key:
AGXVEALMQHTMSW-UHFFFAOYSA-N
SMILES:
NCCc1ncn(c1)C.Cl.Cl

Properties

Complexity:
84.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.049g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
198.091g/mol
Monoisotopic Mass:
197.049g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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