4-Acetamido-3-chlorobenzenesulfonyl Chloride - CAS 16761-18-5
Catalog: |
BB012403 |
Product Name: |
4-Acetamido-3-chlorobenzenesulfonyl Chloride |
CAS: |
16761-18-5 |
Synonyms: |
4-acetamido-3-chlorobenzenesulfonyl chloride; 4-acetamido-3-chlorobenzenesulfonyl chloride |
IUPAC Name: | 4-acetamido-3-chlorobenzenesulfonyl chloride |
Description: | 4-Acetamido-3-chlorobenzenesulfonyl Chloride (CAS# 16761-18-5) is a useful research chemical. |
Molecular Weight: | 268.12 |
Molecular Formula: | C8H7Cl2NO3S |
Canonical SMILES: | CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)Cl)Cl |
InChI: | InChI=1S/C8H7Cl2NO3S/c1-5(12)11-8-3-2-6(4-7(8)9)15(10,13)14/h2-4H,1H3,(H,11,12) |
InChI Key: | ALOQYFFSHSEVJH-UHFFFAOYSA-N |
Boiling Point: | 447.3 °C at 760 mmHg |
Density: | 1.566 g/cm3 |
Appearance: | Solid |
MDL: | MFCD00052363 |
LogP: | 3.37970 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-105732597-A | Intermediate compounds for preparing pyrrole amide compounds, preparation method and applications thereof | 20141229 |
CN-105801464-A | Pyrrolic amide compound and its preparation method and use | 20141229 |
EP-3241823-A1 | Pyrrole amide compound, preparation method therefor, and use thereof | 20141229 |
EP-3241823-B1 | Pyrrole amide compound, preparation method therefor, and use thereof | 20141229 |
JP-2018503683-A | Pyrrolamide compound, production method and use thereof | 20141229 |
Complexity: | 338 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.9523696 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.9523696 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 71.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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