2-(3-Butynyloxy)tetrahydro-2H-pyran - CAS 40365-61-5
Catalog: |
BB024471 |
Product Name: |
2-(3-Butynyloxy)tetrahydro-2H-pyran |
CAS: |
40365-61-5 |
Synonyms: |
2-but-3-ynoxyoxane |
IUPAC Name: | 2-but-3-ynoxyoxane |
Description: | 2-(3-Butynyloxy)tetrahydro-2H-pyran (CAS# 40365-61-5) is used as a reagent in the synthesis of Phomoidride D, a bridged, polycyclic, natural compound that has the ability to inhibit squalene synthase and can be used as an antihypercholesterolemic agent. 2-(3-Butynyloxy)tetrahydro-2H-pyran is also used as a reagent to prepare Rugulactone, a natural compound that is isolated from Cryptocarya rugulosa. |
Molecular Weight: | 154.21 |
Molecular Formula: | C9H14O2 |
Canonical SMILES: | C#CCCOC1CCCCO1 |
InChI: | InChI=1S/C9H14O2/c1-2-3-7-10-9-6-4-5-8-11-9/h1,9H,3-8H2 |
InChI Key: | ZQZSNKJFOFAJQX-UHFFFAOYSA-N |
Boiling Point: | 206.6 ℃ at 760 mmHg |
Density: | 0.984 g/cm3 |
Appearance: | Colorless to yellow liquid |
MDL: | MFCD00012352 |
LogP: | 1.55290 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021067606-A1 | Brm targeting compounds and associated methods of use | 20191001 |
US-2020317627-A1 | Catalytic systems for stereoselective synthesis of chiral amines by enantiodivergent radical c-h amination | 20190405 |
WO-2020198685-A1 | Compositions, devices and methods for treating fabry disease | 20190327 |
WO-2020198695-A1 | Compositions, devices and methods for factor vii therapy | 20190327 |
WO-2019195055-A1 | Implantable particles and related methods | 20180404 |
Complexity: | 145 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.099379685 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.099379685 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 18.5 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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