200,000+ products from a single source!
sales@angenechem.com
1501-08-2 | 1H-Pyrrole-3,4-dicarbonitrile, 2-amino-5-(ethylthio)-
CAS No: 1501-08-2 Catalog No: AG001MC5 MDL No:
Product Description
Catalog Number:
AG001MC5
Chemical Name:
1H-Pyrrole-3,4-dicarbonitrile, 2-amino-5-(ethylthio)-
CAS Number:
1501-08-2
Molecular Formula:
C8H8N4S
Molecular Weight:
192.2409
IUPAC Name:
2-amino-5-ethylsulfanyl-1H-pyrrole-3,4-dicarbonitrile
InChI:
InChI=1S/C8H8N4S/c1-2-13-8-6(4-10)5(3-9)7(11)12-8/h12H,2,11H2,1H3
InChI Key:
HPLXQDYPMZVLOB-UHFFFAOYSA-N
SMILES:
CCSc1[nH]c(c(c1C#N)C#N)N
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.047g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.24g/mol
Monoisotopic Mass:
192.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.