Home Other Building Blocks 3-(piperidin-3-yl)-1H-1,2,4-triazol-5-amine dihydrochloride

3-(piperidin-3-yl)-1H-1,2,4-triazol-5-amine dihydrochloride

CAS No.:
1803595-12-1
Catalog Number:
AG01BB78
Molecular Formula:
C7H15Cl2N5
Molecular Weight:
240.1335
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Product Description
Catalog Number:
AG01BB78
Chemical Name:
3-(piperidin-3-yl)-1H-1,2,4-triazol-5-amine dihydrochloride
CAS Number:
1803595-12-1
Molecular Formula:
C7H15Cl2N5
Molecular Weight:
240.1335
MDL Number:
MFCD28714557
IUPAC Name:
5-piperidin-3-yl-1H-1,2,4-triazol-3-amine;dihydrochloride
InChI:
InChI=1S/C7H13N5.2ClH/c8-7-10-6(11-12-7)5-2-1-3-9-4-5;;/h5,9H,1-4H2,(H3,8,10,11,12);2*1H
InChI Key:
KBIFCYZCOPYVGI-UHFFFAOYSA-N
SMILES:
Nc1[nH]nc(n1)C1CCCNC1.Cl.Cl
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.07g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
240.132g/mol
Monoisotopic Mass:
239.07g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
79.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties