4-Ethoxy-benzenesulfonyl chloride - CAS 1132-17-8
Catalog: |
BB050471 |
Product Name: |
4-Ethoxy-benzenesulfonyl chloride |
CAS: |
1132-17-8 |
Synonyms: |
4-Ethoxybenzenesulfonyl chloride; 4-ethoxybenzene-1-sulfonyl chloride; Benzenesulfonyl chloride, 4-ethoxy- |
IUPAC Name: | 4-ethoxybenzenesulfonyl chloride |
Description: | 4-Ethoxy-benzenesulfonyl chloride (CAS# 1132-17-8 ) is a useful research chemical. |
Molecular Weight: | 220.67 |
Molecular Formula: | C8H9ClO3S |
Canonical SMILES: | CCOC1=CC=C(C=C1)S(=O)(=O)Cl |
InChI: | InChI=1S/C8H9ClO3S/c1-2-12-7-3-5-8(6-4-7)13(9,10)11/h3-6H,2H2,1H3 |
InChI Key: | XIWSSFMVSKKXRJ-UHFFFAOYSA-N |
Boiling Point: | 327.9±15.0 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.3±0.1 g/cm3 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]; H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 |
Signal Word: | Danger |
Complexity: | 237 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.996093 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.996093 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 51.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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