Home Aminos 5-(2-aminoethyl)-4-methyl-4H-1,2,4-triazole-3-thiol hydrochloride

5-(2-aminoethyl)-4-methyl-4H-1,2,4-triazole-3-thiol hydrochloride

CAS No.:
1258652-03-7
Catalog Number:
AG01AAV4
Molecular Formula:
C5H11ClN4S
Molecular Weight:
194.6856
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Product Description
Catalog Number:
AG01AAV4
Chemical Name:
5-(2-aminoethyl)-4-methyl-4H-1,2,4-triazole-3-thiol hydrochloride
CAS Number:
1258652-03-7
Molecular Formula:
C5H11ClN4S
Molecular Weight:
194.6856
MDL Number:
MFCD17480441
IUPAC Name:
3-(2-aminoethyl)-4-methyl-1H-1,2,4-triazole-5-thione;hydrochloride
InChI:
InChI=1S/C5H10N4S.ClH/c1-9-4(2-3-6)7-8-5(9)10;/h2-3,6H2,1H3,(H,8,10);1H
InChI Key:
HNUDVBPDYVNKOE-UHFFFAOYSA-N
SMILES:
Cn1c(CCN)nnc1S.Cl
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.039g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
194.681g/mol
Monoisotopic Mass:
194.039g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
85.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties