200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 20654-47-1
20654-47-1 | Pentanenitrile, 2,2-dimethyl-
CAS No: 20654-47-1 Catalog No: AG002IIT MDL No:
Product Description
Catalog Number:
AG002IIT
Chemical Name:
Pentanenitrile, 2,2-dimethyl-
CAS Number:
20654-47-1
Molecular Formula:
C7H13N
Molecular Weight:
111.1848
IUPAC Name:
2,2-dimethylpentanenitrile
InChI:
InChI=1S/C7H13N/c1-4-5-7(2,3)6-8/h4-5H2,1-3H3
InChI Key:
TZJQCUDHKUWEFU-UHFFFAOYSA-N
SMILES:
CCCC(C#N)(C)C
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.105g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
111.188g/mol
Monoisotopic Mass:
111.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Toward a continuous intravascular glucose monitoring system. | Sensors (Basel, Switzerland) 20110101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.