3-Methoxybenzenesulfonamide - CAS 58734-57-9
Catalog: |
BB030141 |
Product Name: |
3-Methoxybenzenesulfonamide |
CAS: |
58734-57-9 |
Synonyms: |
3-methoxybenzenesulfonamide; 3-methoxybenzenesulfonamide |
IUPAC Name: | 3-methoxybenzenesulfonamide |
Description: | 3-Methoxybenzenesulfonamide (CAS# 58734-57-9) is a useful research chemical. |
Molecular Weight: | 187.22 |
Molecular Formula: | C7H9NO3S |
Canonical SMILES: | COC1=CC(=CC=C1)S(=O)(=O)N |
InChI: | InChI=1S/C7H9NO3S/c1-11-6-3-2-4-7(5-6)12(8,9)10/h2-5H,1H3,(H2,8,9,10) |
InChI Key: | VBKIEQKVSHDVGH-UHFFFAOYSA-N |
Boiling Point: | 363.9 ℃ at 760 mmHg |
Density: | 1.314 g/cm3 |
Solubility: | Insoluble in water |
Appearance: | White powder |
MDL: | MFCD08704579 |
LogP: | 2.12370 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111362857-A | Compound with indoline skeleton, preparation method and medical application thereof | 20200423 |
WO-2021198745-A1 | Drug for prevention or treatment of irritable bowel syndrome or inflammatory bowel disease | 20200330 |
WO-2021188728-A1 | Selective non-cyclic nucleotide activators for the camp sensor epac1 | 20200317 |
WO-2019123482-A1 | Pharmaceutical composition for the treatment of cancer | 20171219 |
AU-2018389313-A1 | Pharmaceutical composition for the treatment of cancer | 20171219 |
Complexity: | 232 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 187.03031432 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 187.03031432 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 77.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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