200,000+ products from a single source!
sales@angenechem.com
151291-05-3 | 1H-Pyrazole-4-carbonitrile, 3-amino-1-methyl-5-(methylthio)-
CAS No: 151291-05-3 Catalog No: AG001N8K MDL No:MFCD02089753
Product Description
Catalog Number:
AG001N8K
Chemical Name:
1H-Pyrazole-4-carbonitrile, 3-amino-1-methyl-5-(methylthio)-
CAS Number:
151291-05-3
Molecular Formula:
C6H8N4S
Molecular Weight:
168.2195
MDL Number:
MFCD02089753
IUPAC Name:
3-amino-1-methyl-5-methylsulfanylpyrazole-4-carbonitrile
InChI:
InChI=1S/C6H8N4S/c1-10-6(11-2)4(3-7)5(8)9-10/h1-2H3,(H2,8,9)
InChI Key:
BIQAGSSFDBPDNT-UHFFFAOYSA-N
SMILES:
CSc1n(C)nc(c1C#N)N
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.047g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.218g/mol
Monoisotopic Mass:
168.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.