1-Cyano-N,N-dimethylmethanesulfonamide - CAS 926265-18-1
Catalog: |
BB069145 |
Product Name: |
1-Cyano-N,N-dimethylmethanesulfonamide |
CAS: |
926265-18-1 |
Synonyms: |
1-Cyano-N,N-dimethylmethanesulfonamide |
IUPAC Name: | 1-cyano-N,N-dimethylmethanesulfonamide |
Description: | A sulfonamide derivative used in the preparation of antibiotics and other pharmaceutical compounds. |
Molecular Weight: | 148.18 |
Molecular Formula: | C4H8N2O2S |
Canonical SMILES: | CN(C)S(=O)(=O)CC#N |
InChI: | InChI=1S/C4H8N2O2S/c1-6(2)9(7,8)4-3-5/h4H2,1-2H3 |
InChI Key: | HYLLRLMSCNHPBI-UHFFFAOYSA-N |
Complexity: | 215 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 148.03064868 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 148.03064868 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 69.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.7 |
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