tert-Butyl 2-Iodoacetate - CAS 49827-15-8
Catalog: |
BB026833 |
Product Name: |
tert-Butyl 2-Iodoacetate |
CAS: |
49827-15-8 |
Synonyms: |
2-iodoacetic acid tert-butyl ester; tert-butyl 2-iodoacetate |
IUPAC Name: | tert-butyl 2-iodoacetate |
Description: | tert-Butyl 2-Iodoacetate (CAS# 49827-15-8) is used in the synthesis and biological evaluation of water-soluble derivative of potent V-ATPase inhibitor archazolid. |
Molecular Weight: | 242.05 |
Molecular Formula: | C6H11IO2 |
Canonical SMILES: | CC(C)(C)OC(=O)CI |
InChI: | InChI=1S/C6H11IO2/c1-6(2,3)9-5(8)4-7/h4H2,1-3H3 |
InChI Key: | QYPDJIDQEZDFLS-UHFFFAOYSA-N |
LogP: | 1.76310 |
Publication Number | Title | Priority Date |
CN-113461591-A | Preparation method of precursor raw material Pht-AEEA-AEEA for side chain of Somalutide | 20210812 |
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EP-3833657-A1 | Aminothiolester compounds and uses thereof | 20190731 |
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Complexity: | 104 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.98038 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.98038 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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