Home Other Building Blocks 4-cyclopropyl-4H-1,2,4-triazol-3-amine hydroiodide

4-cyclopropyl-4H-1,2,4-triazol-3-amine hydroiodide

CAS No.:
1803603-86-2
Catalog Number:
AG01B9EN
Molecular Formula:
C5H9IN4
Molecular Weight:
252.0562
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Product Description
Catalog Number:
AG01B9EN
Chemical Name:
4-cyclopropyl-4H-1,2,4-triazol-3-amine hydroiodide
CAS Number:
1803603-86-2
Molecular Formula:
C5H9IN4
Molecular Weight:
252.0562
MDL Number:
MFCD28383838
IUPAC Name:
4-cyclopropyl-1,2,4-triazol-3-amine;hydroiodide
InChI:
InChI=1S/C5H8N4.HI/c6-5-8-7-3-9(5)4-1-2-4;/h3-4H,1-2H2,(H2,6,8);1H
InChI Key:
TVPMCYDMNGHZRF-UHFFFAOYSA-N
SMILES:
Nc1nncn1C1CC1.I
Properties
Complexity:
112  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.987g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
252.059g/mol
Monoisotopic Mass:
251.987g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties