tert-butyl 4,4-Dimethyl-2,2-dioxooxathiazolidine-3-carboxylate - CAS 454248-55-6
Catalog: |
BB025859 |
Product Name: |
tert-butyl 4,4-Dimethyl-2,2-dioxooxathiazolidine-3-carboxylate |
CAS: |
454248-55-6 |
Synonyms: |
tert-butyl 4,4-dimethyl-2,2-dioxooxathiazolidine-3-carboxylate |
IUPAC Name: | tert-butyl 4,4-dimethyl-2,2-dioxooxathiazolidine-3-carboxylate |
Description: | tert-butyl 4,4-Dimethyl-2,2-dioxooxathiazolidine-3-carboxylate (CAS# 454248-55-6) is a useful research chemical. |
Molecular Weight: | 251.30 |
Molecular Formula: | C9H17NO5S |
Canonical SMILES: | CC1(COS(=O)(=O)N1C(=O)OC(C)(C)C)C |
InChI: | InChI=1S/C9H17NO5S/c1-8(2,3)15-7(11)10-9(4,5)6-14-16(10,12)13/h6H2,1-5H3 |
InChI Key: | BNXUCYJCRZGFLG-UHFFFAOYSA-N |
Purity: | 95 % |
LogP: | 2.29580 |
Publication Number | Title | Priority Date |
CN-113336774-A | Substituted chiral diaryl macrocycles as TRK inhibitors | 20210625 |
WO-2021204855-A1 | Microbiocidal quinoline dihydropyrrolopyrazine derivatives | 20200408 |
CN-111303078-A | Synthesis method of tert-butyl 1,2, 3-thiazolidine-3-carboxylate 2, 2-dioxide compound | 20200402 |
WO-2021190727-A1 | Compounds and their use in the treatment of bacterial infection | 20200324 |
US-2021163499-A1 | Macrocycles for use in treating disease | 20191203 |
Complexity: | 387 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 251.08274382 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 251.08274382 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 81.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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