N-(2-Fluorophenyl)methanesulfonamide - CAS 98611-90-6
Catalog: |
BB042197 |
Product Name: |
N-(2-Fluorophenyl)methanesulfonamide |
CAS: |
98611-90-6 |
Synonyms: |
N-(2-fluorophenyl)methanesulfonamide |
IUPAC Name: | N-(2-fluorophenyl)methanesulfonamide |
Description: | N-(2-Fluorophenyl)methanesulfonamide (CAS# 98611-90-6) is a useful research chemical. |
Molecular Weight: | 189.21 |
Molecular Formula: | C7H8FNO2S |
Canonical SMILES: | CS(=O)(=O)NC1=CC=CC=C1F |
InChI: | InChI=1S/C7H8FNO2S/c1-12(10,11)9-7-5-3-2-4-6(7)8/h2-5,9H,1H3 |
InChI Key: | DJLCKPRURZWUOU-UHFFFAOYSA-N |
MDL: | MFCD01212921 |
LogP: | 2.35100 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2020119590-A1 | 3-cyanopyridine compound, pharmaceutical composition comprising same, preparation method therefor, and uses thereof. | 20181211 |
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Complexity: | 234 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.02597783 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.02597783 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 54.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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