1-Bromo-3-(4-chlorophenoxymethyl)benzene - CAS 859777-31-4
Catalog: |
BB072152 |
Product Name: |
1-Bromo-3-(4-chlorophenoxymethyl)benzene |
CAS: |
859777-31-4 |
Synonyms: |
3-Bromobenzyl-(4-chlorophenyl)ether; 1-BROMO-3-(4-CHLOROPHENOXYMETHYL)BENZENE; 1-Bromo-3-((4-chlorophenoxy)methyl)benzene; 1-bromo-3-[(4-chlorophenoxy)methyl]benzene |
IUPAC Name: | 1-bromo-3-[(4-chlorophenoxy)methyl]benzene |
Description: | 1-Bromo-3-(4-chlorophenoxymethyl)benzene |
Molecular Weight: | 297.57 |
Molecular Formula: | C13H10BrClO |
Canonical SMILES: | C1=CC(=CC(=C1)Br)COC2=CC=C(C=C2)Cl |
InChI: | InChI=1S/C13H10BrClO/c14-11-3-1-2-10(8-11)9-16-13-6-4-12(15)5-7-13/h1-8H,9H2 |
InChI Key: | USWBOCNFGYIJCD-UHFFFAOYSA-N |
Complexity: | 204 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 295.96036 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 295.96036 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 9.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.7 |
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