Ethyl 2-Chloro-6-(methylsulfonamido)benzoate - CAS 1447213-80-0
Catalog: |
BB009827 |
Product Name: |
Ethyl 2-Chloro-6-(methylsulfonamido)benzoate |
CAS: |
1447213-80-0 |
Synonyms: |
2-chloro-6-(methanesulfonamido)benzoic acid ethyl ester; ethyl 2-chloro-6-(methanesulfonamido)benzoate |
IUPAC Name: | ethyl 2-chloro-6-(methanesulfonamido)benzoate |
Description: | Ethyl 2-Chloro-6-(methylsulfonamido)benzoate (CAS# 1447213-80-0) is a useful research chemical. |
Molecular Weight: | 277.72 |
Molecular Formula: | C10H12ClNO4S |
Canonical SMILES: | CCOC(=O)C1=C(C=CC=C1Cl)NS(=O)(=O)C |
InChI: | InChI=1S/C10H12ClNO4S/c1-3-16-10(13)9-7(11)5-4-6-8(9)12-17(2,14)15/h4-6,12H,3H2,1-2H3 |
InChI Key: | OMQFQSWXBYOKLG-UHFFFAOYSA-N |
LogP: | 3.04200 |
Complexity: | 365 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 277.0175567 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 277.0175567 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 80.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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