Home Other Building Blocks 3-(Methylthio)-1H-pyrazol-5-amine

3-(Methylthio)-1H-pyrazol-5-amine

CAS No.:
117736-74-0
Catalog Number:
AG008Z3C
Molecular Formula:
C4H7N3S
Molecular Weight:
129.1835
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Product Description
Catalog Number:
AG008Z3C
Chemical Name:
3-(Methylthio)-1H-pyrazol-5-amine
CAS Number:
117736-74-0
Molecular Formula:
C4H7N3S
Molecular Weight:
129.1835
MDL Number:
MFCD11976664
IUPAC Name:
3-methylsulfanyl-1H-pyrazol-5-amine
InChI:
InChI=1S/C4H7N3S/c1-8-4-2-3(5)6-7-4/h2H,1H3,(H3,5,6,7)
InChI Key:
NPBDQUSJACEGDI-UHFFFAOYSA-N
SMILES:
CSc1cc(n[nH]1)N
Properties
Complexity:
77.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.036g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
129.181g/mol
Monoisotopic Mass:
129.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties