6-Methoxybenzothiazole - CAS 2942-13-4
Catalog: |
BB020194 |
Product Name: |
6-Methoxybenzothiazole |
CAS: |
2942-13-4 |
Synonyms: |
6-methoxy-1,3-benzothiazole; 6-methoxy-1,3-benzothiazole |
IUPAC Name: | 6-methoxy-1,3-benzothiazole |
Description: | 6-Methoxybenzothiazole (CAS# 2942-13-4) is a useful research chemical. |
Molecular Weight: | 165.21 |
Molecular Formula: | C8H7NOS |
Canonical SMILES: | COC1=CC2=C(C=C1)N=CS2 |
InChI: | InChI=1S/C8H7NOS/c1-10-6-2-3-7-8(4-6)11-5-9-7/h2-5H,1H3 |
InChI Key: | AHOIGFLSEXUWNV-UHFFFAOYSA-N |
Boiling Point: | 274.4 °C at 760 mmHg |
Density: | 1.268 g/cm3 |
MDL: | MFCD01961206 |
LogP: | 2.30490 |
Publication Number | Title | Priority Date |
CN-113072520-A | C2 substituted 2H-benzothiazole aryl acylation derivative and synthesis method and application thereof | 20210406 |
JP-2021147470-A | Wavelength Selective Transparency Polycarbonate Resin Composition | 20200318 |
CN-111039893-A | Preparation method of substituted benzothiazole C2 arylation derivative | 20200119 |
CN-111039893-B | Preparation method of substituted benzothiazole C2 arylation derivative | 20200119 |
CN-110698373-A | Preparation method of N- (2- (methylthio) phenyl) acetamide compound and purification method thereof | 20191107 |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.02483502 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.02483502 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 50.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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