3-[(3-Bromophenoxy)methyl]benzoic acid - CAS 148255-32-7
Catalog: |
BB045131 |
Product Name: |
3-[(3-Bromophenoxy)methyl]benzoic acid |
CAS: |
148255-32-7 |
Synonyms: |
3-(3-Bromo-phenoxymethyl)-benzoic acid |
IUPAC Name: | 3-[(3-bromophenoxy)methyl]benzoic acid |
Description: | 3-[(3-Bromophenoxy)methyl]benzoic acid (CAS# 148255-32-7 ) is a useful research chemical. |
Molecular Weight: | 307.14 |
Molecular Formula: | C14H11BrO3 |
Canonical SMILES: | C1=CC(=CC(=C1)C(=O)O)COC2=CC(=CC=C2)Br |
InChI: | InChI=1S/C14H11BrO3/c15-12-5-2-6-13(8-12)18-9-10-3-1-4-11(7-10)14(16)17/h1-8H,9H2,(H,16,17) |
InChI Key: | AAHNOGQOOXVFDZ-UHFFFAOYSA-N |
Complexity: | 282 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 305.98916 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 305.98916 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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