Home Other Building Blocks 3-(1H-1,2,4-triazol-1-yl)propanimidamide dihydrochloride

3-(1H-1,2,4-triazol-1-yl)propanimidamide dihydrochloride

CAS No.:
1221724-51-1
Catalog Number:
AG01A87B
Molecular Formula:
C5H11Cl2N5
Molecular Weight:
212.0803
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Product Description
Catalog Number:
AG01A87B
Chemical Name:
3-(1H-1,2,4-triazol-1-yl)propanimidamide dihydrochloride
CAS Number:
1221724-51-1
Molecular Formula:
C5H11Cl2N5
Molecular Weight:
212.0803
MDL Number:
MFCD15209651
IUPAC Name:
3-(1,2,4-triazol-1-yl)propanimidamide;dihydrochloride
InChI:
InChI=1S/C5H9N5.2ClH/c6-5(7)1-2-10-4-8-3-9-10;;/h3-4H,1-2H2,(H3,6,7);2*1H
InChI Key:
JZPHUYUGIYLRBP-UHFFFAOYSA-N
SMILES:
NC(=N)CCn1ncnc1.Cl.Cl
Properties
Complexity:
123  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.039g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
212.078g/mol
Monoisotopic Mass:
211.039g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties