5-(Aminomethyl)benzofuran - CAS 37798-08-6
Catalog: |
BB023426 |
Product Name: |
5-(Aminomethyl)benzofuran |
CAS: |
37798-08-6 |
Synonyms: |
5-benzofuranylmethanamine; 1-benzofuran-5-ylmethanamine |
IUPAC Name: | 1-benzofuran-5-ylmethanamine |
Description: | 5-(Aminomethyl)benzofuran (CAS# 37798-08-6) is a useful reagent in preparation of aminoparthenolide analogs via diastereoselective conjugate addition. |
Molecular Weight: | 147.17 |
Molecular Formula: | C9H9NO |
Canonical SMILES: | C1=CC2=C(C=CO2)C=C1CN |
InChI: | InChI=1S/C9H9NO/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5H,6,10H2 |
InChI Key: | OFMIMSPBHXZKRI-UHFFFAOYSA-N |
Boiling Point: | 254.3 °C at 760 mmHg |
Density: | 1.164 g/cm3 |
Appearance: | Solid |
LogP: | 2.59180 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2018321546-A1 | Compounds, salts thereof and methods for treatment of diseases | 20170821 |
CA-3071644-A1 | Compounds, salts thereof and methods for treatment of diseases | 20170821 |
EP-3672954-A1 | Compounds, salts thereof and methods for treatment of diseases | 20170821 |
KR-20200043409-A | Compounds for the treatment of diseases, salts and methods thereof | 20170821 |
WO-2019040107-A1 | COMPOUNDS, CORRESPONDING SALTS AND METHODS FOR THE TREATMENT OF DISEASES | 20170821 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 147.068413911 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 147.068413911 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 39.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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Benzofuran/Benzothiophene
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