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Home Other Building Blocks 4-(pyridin-4-ylmethoxy)benzene-1-carboximidamide trihydrochloride

4-(pyridin-4-ylmethoxy)benzene-1-carboximidamide trihydrochloride

CAS No.:
1221724-14-6
Catalog Number:
AG01A7NS
Molecular Formula:
C13H16Cl3N3O
Molecular Weight:
336.6446
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Product Description
Catalog Number:
AG01A7NS
Chemical Name:
4-(pyridin-4-ylmethoxy)benzene-1-carboximidamide trihydrochloride
CAS Number:
1221724-14-6
Molecular Formula:
C13H16Cl3N3O
Molecular Weight:
336.6446
MDL Number:
MFCD14705745
IUPAC Name:
4-(pyridin-4-ylmethoxy)benzenecarboximidamide;trihydrochloride
InChI:
InChI=1S/C13H13N3O.3ClH/c14-13(15)11-1-3-12(4-2-11)17-9-10-5-7-16-8-6-10;;;/h1-8H,9H2,(H3,14,15);3*1H
InChI Key:
XSJDWDACNMXPQN-UHFFFAOYSA-N
SMILES:
NC(=N)c1ccc(cc1)OCc1ccncc1.Cl.Cl.Cl
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.036g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
336.641g/mol
Monoisotopic Mass:
335.036g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties