2-(Methylsulfonamido)phenylacetonitrile - CAS 36268-70-9
Catalog: |
BB022925 |
Product Name: |
2-(Methylsulfonamido)phenylacetonitrile |
CAS: |
36268-70-9 |
Synonyms: |
N-[2-(cyanomethyl)phenyl]methanesulfonamide; N-[2-(cyanomethyl)phenyl]methanesulfonamide |
IUPAC Name: | N-[2-(cyanomethyl)phenyl]methanesulfonamide |
Description: | 2-(Methylsulfonamido)phenylacetonitrile (CAS# 36268-70-9 ) is a useful research chemical. |
Molecular Weight: | 210.25 |
Molecular Formula: | C9H10N2O2S |
Canonical SMILES: | CS(=O)(=O)NC1=CC=CC=C1CC#N |
InChI: | InChI=1S/C9H10N2O2S/c1-14(12,13)11-9-5-3-2-4-8(9)6-7-10/h2-5,11H,6H2,1H3 |
InChI Key: | YHHDVFAYFWDZCS-UHFFFAOYSA-N |
LogP: | 0.00000 |
Publication Number | Title | Priority Date |
AU-2001280229-B2 | Novel thiourea derivatives and the pharmaceutical compositions containing the same | 20000821 |
CA-2417507-A1 | Novel thiourea derivatives and the pharmaceutical compositions containing the same | 20000821 |
CN-100439332-C | Novel thiourea derivatives and the pharmaceutical compositions containing thd same | 20000821 |
CN-1418191-A | Novel thiourea derivatives and the pharmaceutical compositions containing thd same | 20000821 |
DE-60133743-T2 | NEW THIOUREA DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | 20000821 |
Complexity: | 323 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.04629874 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.04629874 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 78.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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