4-Chloro-5-(chlorosulfonyl)-2-methoxybenzoic acid - CAS 57479-73-9
Catalog: |
BB062472 |
Product Name: |
4-Chloro-5-(chlorosulfonyl)-2-methoxybenzoic acid |
CAS: |
57479-73-9 |
Synonyms: |
4-Chloro-5-(chlorosulfonyl)-2-methoxybenzoic acid; 4-chloro-5-chlorosulfonyl-2-methoxybenzoic acid |
IUPAC Name: | 4-chloro-5-chlorosulfonyl-2-methoxybenzoic acid |
Description: | 4-Chloro-5-(chlorosulfonyl)-2-methoxybenzoic acid |
Molecular Weight: | 285.1 |
Molecular Formula: | C8H6Cl2O5S |
Canonical SMILES: | COC1=CC(=C(C=C1C(=O)O)S(=O)(=O)Cl)Cl |
InChI: | InChI=1S/C8H6Cl2O5S/c1-15-6-3-5(9)7(16(10,13)14)2-4(6)8(11)12/h2-3H,1H3,(H,11,12) |
InChI Key: | KGGQSUTYQMJRNQ-UHFFFAOYSA-N |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
KR-830001276-B1 | Method for preparing substituted heterocycle benzamide | 19790119 |
CA-1133477-A | Novel substituted heterocyclic benzamides, process for their preparation and use as behaviour modifiers | 19780120 |
CH-639369-A5 | SUBSTITUTED HETEROCYCLIC BENZAMIDES AND PROCESSES FOR THEIR PREPARATION. | 19780120 |
DD-141521-A5 | METHOD FOR PRODUCING NEW HETEROCYCLIC BENZAMIDES | 19780120 |
DE-2901170-A1 | SUBSTITUTED HETEROCYCLIC BENZAMIDES, THE METHOD OF MANUFACTURING THEM AND THE MEDICINAL PRODUCTS CONTAINING THESE | 19780120 |
NZ-189381-A | Substituted heterocyclic benzamides and pharmaceutical compositions | 19780120 |
PL-117195-B1 | Method of manufacture of novel derivatives of pyrrolidinyl-or pyrrolidinylalkylbenzamidepirolidinilalkilbenzamida | 19780120 |
SU-1158040-A3 | Method of obtaining heterocyclicbenzamides or salts thereof | 19780120 |
US-4673686-A | New substituted heterocyclic benzamides, methods of preparing them and their application as behavior modifiers | 19780120 |
DE-2721643-A1 | PROCESS FOR THE MANUFACTURING OF SQUARE CLAMP ON N, N-DIALKYLAMINO-ALKYL SQUARE CLAMP FOR -2-ALKOXY-5-SULPHAMOYLBENZAMIDES | 19770513 |
Complexity: | 363 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 283.9312998 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 283.9312998 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 89Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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