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1798700-80-7

1798700-80-7 | 2-(1-methyl-1H-imidazol-2-yl)piperazine trihydrochloride

CAS No: 1798700-80-7 Catalog No: AG01BE4S MDL No:MFCD28063956

Product Description

Catalog Number:
AG01BE4S
Chemical Name:
2-(1-methyl-1H-imidazol-2-yl)piperazine trihydrochloride
CAS Number:
1798700-80-7
Molecular Formula:
C8H17Cl3N4
Molecular Weight:
275.6064
MDL Number:
MFCD28063956
IUPAC Name:
2-(1-methylimidazol-2-yl)piperazine;trihydrochloride
InChI:
InChI=1S/C8H14N4.3ClH/c1-12-5-4-11-8(12)7-6-9-2-3-10-7;;;/h4-5,7,9-10H,2-3,6H2,1H3;3*1H
InChI Key:
OGHQXHDJIOFSEQ-UHFFFAOYSA-N
SMILES:
Cn1ccnc1C1CNCCN1.Cl.Cl.Cl

Properties

Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.052g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
275.602g/mol
Monoisotopic Mass:
274.052g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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