3-(Iodomethyl)-3-methyloxetane - CAS 112823-30-0
Catalog: |
BB003054 |
Product Name: |
3-(Iodomethyl)-3-methyloxetane |
CAS: |
112823-30-0 |
Synonyms: |
3-(iodomethyl)-3-methyloxetane; 3-(iodomethyl)-3-methyloxetane |
IUPAC Name: | 3-(iodomethyl)-3-methyloxetane |
Description: | 3-(Iodomethyl)-3-methyloxetane (CAS# 112823-30-0) is a useful research chemical. |
Molecular Weight: | 212.03 |
Molecular Formula: | C5H9IO |
Canonical SMILES: | CC1(COC1)CI |
InChI: | InChI=1S/C5H9IO/c1-5(2-6)3-7-4-5/h2-4H2,1H3 |
InChI Key: | UAYNHSVKPDQASH-UHFFFAOYSA-N |
Boiling Point: | 187.696 °C at 760 mmHg |
Density: | 1.762 g/cm3 |
Storage: | Keep in dark place, Inert atmosphere, 2-8 °C |
MDL: | MFCD11553032 |
LogP: | 1.45790 |
GHS Hazard Statement: | H227 (100%): Combustible liquid [Warning Flammable liquids] |
Precautionary Statement: | P210, P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P370+P378, P403+P233, P403+P235, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021108683-A1 | Covalent ras inhibitors and uses thereof | 20191127 |
US-2021130326-A1 | Ras inhibitors | 20191104 |
WO-2021091967-A1 | Ras inhibitors | 20191104 |
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Complexity: | 68.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.96981 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.96981 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 9.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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Oxetane/Thietane
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