Home Other Building Blocks [2-(1H-1,2,4-triazol-1-ylmethyl)phenyl]methanamine dihydrochloride

[2-(1H-1,2,4-triazol-1-ylmethyl)phenyl]methanamine dihydrochloride

CAS No.:
1803594-21-9
Catalog Number:
AG01B92R
Molecular Formula:
C10H14Cl2N4
Molecular Weight:
261.1510
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Product Description
Catalog Number:
AG01B92R
Chemical Name:
[2-(1H-1,2,4-triazol-1-ylmethyl)phenyl]methanamine dihydrochloride
CAS Number:
1803594-21-9
Molecular Formula:
C10H14Cl2N4
Molecular Weight:
261.1510
MDL Number:
MFCD28348228
IUPAC Name:
[2-(1,2,4-triazol-1-ylmethyl)phenyl]methanamine;dihydrochloride
InChI:
InChI=1S/C10H12N4.2ClH/c11-5-9-3-1-2-4-10(9)6-14-8-12-7-13-14;;/h1-4,7-8H,5-6,11H2;2*1H
InChI Key:
GOMNCTUCQQJGNF-UHFFFAOYSA-N
SMILES:
NCc1ccccc1Cn1cncn1.Cl.Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.06g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
261.15g/mol
Monoisotopic Mass:
260.06g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties