Home Other Building Blocks [1-(but-3-en-1-yl)-1H-1,2,3-triazol-4-yl]methanamine dihydrochloride

[1-(but-3-en-1-yl)-1H-1,2,3-triazol-4-yl]methanamine dihydrochloride

CAS No.:
1909337-01-4
Catalog Number:
AG01C3ZI
Molecular Formula:
C7H14Cl2N4
Molecular Weight:
225.1189
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Product Description
Catalog Number:
AG01C3ZI
Chemical Name:
[1-(but-3-en-1-yl)-1H-1,2,3-triazol-4-yl]methanamine dihydrochloride
CAS Number:
1909337-01-4
Molecular Formula:
C7H14Cl2N4
Molecular Weight:
225.1189
MDL Number:
MFCD29762945
IUPAC Name:
(1-but-3-enyltriazol-4-yl)methanamine;dihydrochloride
InChI:
InChI=1S/C7H12N4.2ClH/c1-2-3-4-11-6-7(5-8)9-10-11;;/h2,6H,1,3-5,8H2;2*1H
InChI Key:
UMUCZMHWWZPZSB-UHFFFAOYSA-N
SMILES:
NCc1nnn(c1)CCC=C.Cl.Cl
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.06g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
225.117g/mol
Monoisotopic Mass:
224.06g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties