Ethyl 4-(chlorosulphonyl)-2,5-dimethyl-3-furoate - CAS 306936-32-3
Catalog: |
BB065777 |
Product Name: |
Ethyl 4-(chlorosulphonyl)-2,5-dimethyl-3-furoate |
CAS: |
306936-32-3 |
Synonyms: |
Ethyl 4-(chlorosulphonyl)-2,5-dimethyl-3-furoate; ethyl 4-(chlorosulfonyl)-2,5-dimethylfuran-3-carboxylate; Ethyl4-(chlorosulphonyl)-2,5-dimethyl-3-furoate; ethyl 4-chlorosulfonyl-2,5-dimethylfuran-3-carboxylate; ethyl 4-(chlorosulfonyl)-2,5-dimethyl-3-furoate |
IUPAC Name: | ethyl 4-chlorosulfonyl-2,5-dimethylfuran-3-carboxylate |
Description: | Ethyl 4-(chlorosulphonyl)-2,5-dimethyl-3-furoate |
Molecular Weight: | 266.7 |
Molecular Formula: | C9H11ClO5S |
Canonical SMILES: | CCOC(=O)C1=C(OC(=C1S(=O)(=O)Cl)C)C |
InChI: | InChI=1S/C9H11ClO5S/c1-4-14-9(11)7-5(2)15-6(3)8(7)16(10,12)13/h4H2,1-3H3 |
InChI Key: | OPVQUCBSIFLMKM-UHFFFAOYSA-N |
Complexity: | 361 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.0015723 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.0015723 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 82Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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