2,4-Dichloro-6-(4-methoxyphenyl)-1,3,5-triazine - CAS 90723-86-7
Catalog: |
BB067998 |
Product Name: |
2,4-Dichloro-6-(4-methoxyphenyl)-1,3,5-triazine |
CAS: |
90723-86-7 |
Synonyms: |
6-(4-Methoxyphenyl)-2,4-dichloro-1,3,5-triazine; 2,4-Dichloro-6-(p-methoxyphenyl)-s-triazine; 2,4-Dichloro-6-(4-methoxyphenyl)-1,3,5-triazine |
IUPAC Name: | 2,4-dichloro-6-(4-methoxyphenyl)-1,3,5-triazine |
Description: | 2,4-Dichloro-6-(4-methoxyphenyl)-1,3,5-triazine is an intermediate in the synthesis of Bemotrizinol (B131500) broad-spectrum UV absorber, absorbing both UVA and UVB. Bemotrizinol is added to various sunscreens to absorb UV rays. |
Molecular Weight: | 256.09 |
Molecular Formula: | C10H7Cl2N3O |
Canonical SMILES: | COC1=CC=C(C=C1)C2=NC(=NC(=N2)Cl)Cl |
InChI: | InChI=1S/C10H7Cl2N3O/c1-16-7-4-2-6(3-5-7)8-13-9(11)15-10(12)14-8/h2-5H,1H3 |
InChI Key: | JOYIXJKYQUJKQO-UHFFFAOYSA-N |
Solubility: | Benzene, DCM, Ethyl Acetate, |
Appearance: | Off-White Solid |
References: | Sweta, D., et al. Res. J. Chem. Sci., 4, 14 (2014); Jiang, W. F., et al. J. Chem. Res., 11, 664 (2008). |
Complexity: | 214 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 254.9966172 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 254.9966172 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 47.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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