200,000+ products from a single source!
sales@angenechem.com
Home > Thiazole > 1016496-77-7
1016496-77-7 | 2-{4H,5H,6H-cyclopenta[d][1,3]thiazol-2-yl}acetonitrile
CAS No: 1016496-77-7 Catalog No: AG019TN1 MDL No:MFCD09927641
Product Description
Catalog Number:
AG019TN1
Chemical Name:
2-{4H,5H,6H-cyclopenta[d][1,3]thiazol-2-yl}acetonitrile
CAS Number:
1016496-77-7
Molecular Formula:
C8H8N2S
Molecular Weight:
164.2275
MDL Number:
MFCD09927641
IUPAC Name:
2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)acetonitrile
InChI:
InChI=1S/C8H8N2S/c9-5-4-8-10-6-2-1-3-7(6)11-8/h1-4H2
InChI Key:
PRTBXBDREJDDKU-UHFFFAOYSA-N
SMILES:
N#CCc1sc2c(n1)CCC2
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.041g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.226g/mol
Monoisotopic Mass:
164.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.