4-Iodo-3-methoxybenzaldehyde - CAS 121404-83-9
Catalog: |
BB005132 |
Product Name: |
4-Iodo-3-methoxybenzaldehyde |
CAS: |
121404-83-9 |
Synonyms: |
4-iodo-3-methoxybenzaldehyde; 4-iodo-3-methoxybenzaldehyde |
IUPAC Name: | 4-iodo-3-methoxybenzaldehyde |
Description: | 4-Iodo-3-methoxybenzaldehyde (CAS# 121404-83-9) is a useful research chemical. |
Molecular Weight: | 262.04 |
Molecular Formula: | C8H7IO2 |
Canonical SMILES: | COC1=C(C=CC(=C1)C=O)I |
InChI: | InChI=1S/C8H7IO2/c1-11-8-4-6(5-10)2-3-7(8)9/h2-5H,1H3 |
InChI Key: | PHSPBXTVMJOTQN-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 2.11230 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P312, P304+P340, P312, P321, P322, P330, P332+P313, P362, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-111285873-A | RET inhibitors, pharmaceutical compositions thereof and uses thereof | 20181207 |
WO-2020114487-A1 | Ret inhibitors, pharmaceutical compositions and uses thereof | 20181207 |
EP-3891149-A1 | Ret inhibitors, pharmaceutical compositions and uses thereof | 20181207 |
KR-20210100672-A | RET inhibitors, pharmaceutical compositions and uses thereof | 20181207 |
AU-2018361229-A1 | IRAK4 inhibitors and uses thereof | 20171030 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 261.94908 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 261.94908 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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