1-Iodoheptane - CAS 4282-40-0
Catalog: |
BB025239 |
Product Name: |
1-Iodoheptane |
CAS: |
4282-40-0 |
Synonyms: |
1-iodoheptane |
IUPAC Name: | 1-iodoheptane |
Description: | 1-Iodoheptane acts as a reagent in the preparation of glycosyl hydroperoxide, a potential antimalarial agent. |
Molecular Weight: | 226.10 |
Molecular Formula: | C7H15I |
Canonical SMILES: | CCCCCCCI |
InChI: | InChI=1S/C7H15I/c1-2-3-4-5-6-7-8/h2-7H2,1H3 |
InChI Key: | LMHCYRULPLGEEZ-UHFFFAOYSA-N |
Boiling Point: | 204 ℃ |
Density: | 1.379 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD00001104 |
LogP: | 3.39180 |
GHS Hazard Statement: | H315 (97.78%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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CN-112592252-A | Cedrol derivative, preparation method and application thereof | 20201214 |
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PMID | Publication Date | Title | Journal |
22064969 | 20111001 | 1-Heptyl-1,3,6,8-tetraaza-tricyclo-[4.3.1.1]undecan-1-ium iodide | Acta crystallographica. Section E, Structure reports online |
423182 | 19790101 | Synthesis of daunorubicin analogues with novel 9-acyl substituents | Journal of medicinal chemistry |
Complexity: | 35.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.02185 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.02185 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.7 |
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