5-Iodo-2-methylbenzyl Alcohol - CAS 1260242-01-0
Catalog: |
BB006295 |
Product Name: |
5-Iodo-2-methylbenzyl Alcohol |
CAS: |
1260242-01-0 |
Synonyms: |
(5-iodo-2-methylphenyl)methanol; (5-iodo-2-methylphenyl)methanol |
IUPAC Name: | (5-iodo-2-methylphenyl)methanol |
Description: | 5-Iodo-2-methylbenzyl Alcohol (CAS# 1260242-01-0) is a useful research chemical. |
Molecular Weight: | 248.06 |
Molecular Formula: | C8H9IO |
Canonical SMILES: | CC1=C(C=C(C=C1)I)CO |
InChI: | InChI=1S/C8H9IO/c1-6-2-3-8(9)4-7(6)5-10/h2-4,10H,5H2,1H3 |
InChI Key: | CIEQOCDUTRABFK-UHFFFAOYSA-N |
Storage: | Keep in dark place, Sealed in dry, 2-8 °C |
LogP: | 2.09190 |
Publication Number | Title | Priority Date |
US-2020055874-A1 | INHIBITORS OF KEAP1-Nrf2 PROTEIN-PROTEIN INTERACTION | 20180820 |
WO-2020041169-A2 | Inhibitors of keap1-nrf2 protein-protein interaction | 20180820 |
TW-202021594-A | Inhibitors of keap1-nrf2 protein-protein interaction | 20180820 |
US-10947252-B2 | Inhibitors of KEAP1-Nrf2 protein-protein interaction | 20180820 |
EP-3833662-A2 | Inhibitors of keap1-nrf2 protein-protein interaction | 20180820 |
Complexity: | 105 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 247.96981 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 247.96981 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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