2-Benzyloxy-5-bromo-3-chloroanisole - CAS 1345471-50-2
Catalog: |
BB055125 |
Product Name: |
2-Benzyloxy-5-bromo-3-chloroanisole |
CAS: |
1345471-50-2 |
Synonyms: |
2-Benzyloxy-5-bromo-3-chloroanisole; 5-bromo-1-chloro-3-methoxy-2-phenylmethoxybenzene; 2-(BENZYLOXY)-5-BROMO-1-CHLORO-3-METHOXYBENZENE; Benzene, 5-bromo-1-chloro-3-methoxy-2-(phenylmethoxy)- |
IUPAC Name: | 5-bromo-1-chloro-3-methoxy-2-phenylmethoxybenzene |
Description: | 2-Benzyloxy-5-bromo-3-chloroanisole |
Molecular Weight: | 327.6 |
Molecular Formula: | C14H12BrClO2 |
Canonical SMILES: | COC1=C(C(=CC(=C1)Br)Cl)OCC2=CC=CC=C2 |
InChI: | InChI=1S/C14H12BrClO2/c1-17-13-8-11(15)7-12(16)14(13)18-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3 |
InChI Key: | PSGRAIZMYQRZSL-UHFFFAOYSA-N |
Complexity: | 246 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 325.97092 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 325.97092 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 18.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.7 |
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