Home Other Building Blocks 1-(2-METHANESULFONYLETHYL)-1H-PYRAZOL-4-AMINE

1-(2-METHANESULFONYLETHYL)-1H-PYRAZOL-4-AMINE

CAS No.:
1184224-85-8
Catalog Number:
AG01DV1O
Molecular Formula:
C6H11N3O2S
Molecular Weight:
189.2354
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Product Description
Catalog Number:
AG01DV1O
Chemical Name:
1-(2-METHANESULFONYLETHYL)-1H-PYRAZOL-4-AMINE
CAS Number:
1184224-85-8
Molecular Formula:
C6H11N3O2S
Molecular Weight:
189.2354
MDL Number:
MFCD12806104
IUPAC Name:
1-(2-methylsulfonylethyl)pyrazol-4-amine
InChI:
InChI=1S/C6H11N3O2S/c1-12(10,11)3-2-9-5-6(7)4-8-9/h4-5H,2-3,7H2,1H3
InChI Key:
OPCRWTWRJOYCCE-UHFFFAOYSA-N
SMILES:
Nc1cnn(c1)CCS(=O)(=O)C
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.057g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.233g/mol
Monoisotopic Mass:
189.057g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1  
Properties