4-Fluoro-2-[(methylamino)methyl]phenol - CAS 1363166-05-5
Catalog: |
BB008330 |
Product Name: |
4-Fluoro-2-[(methylamino)methyl]phenol |
CAS: |
1363166-05-5 |
Synonyms: |
4-fluoro-2-(methylaminomethyl)phenol; 4-fluoro-2-(methylaminomethyl)phenol |
IUPAC Name: | 4-fluoro-2-(methylaminomethyl)phenol |
Description: | 4-Fluoro-2-[(methylamino)methyl]phenol (CAS# 1363166-05-5) is used as a reactant in the preparation of benziamide compdounds as PPAR agonists. |
Molecular Weight: | 155.17 |
Molecular Formula: | C8H10FNO |
Canonical SMILES: | CNCC1=C(C=CC(=C1)F)O |
InChI: | InChI=1S/C8H10FNO/c1-10-5-6-4-7(9)2-3-8(6)11/h2-4,10-11H,5H2,1H3 |
InChI Key: | NFRQMEOKZASTGF-UHFFFAOYSA-N |
LogP: | 1.64160 |
Publication Number | Title | Priority Date |
WO-2019201282-A1 | Macrocyclic kinase inhibitor | 20180418 |
EP-3783000-A1 | Macrocyclic kinase inhibitor | 20180418 |
US-2021147443-A1 | Macrocyclic kinase inhibitor | 20180418 |
WO-2019157879-A1 | Heterocyclic compound which acts as trk inhibitor | 20180213 |
WO-2019149131-A1 | Compound having macrocyclic molecular structure and use thereof | 20180130 |
Complexity: | 121 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 155.074642105 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 155.074642105 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 32.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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