4-(Benzyloxy)-3-bromophenylacetic Acid - CAS 5884-48-0
Catalog: |
BB030178 |
Product Name: |
4-(Benzyloxy)-3-bromophenylacetic Acid |
CAS: |
5884-48-0 |
Synonyms: |
2-(3-bromo-4-phenylmethoxyphenyl)acetic acid; 2-(3-bromo-4-phenylmethoxyphenyl)acetic acid |
IUPAC Name: | 2-(3-bromo-4-phenylmethoxyphenyl)acetic acid |
Description: | 4-(Benzyloxy)-3-bromophenylacetic Acid (CAS# 5884-48-0) is a useful research chemical compound. |
Molecular Weight: | 321.17 |
Molecular Formula: | C15H13BrO3 |
Canonical SMILES: | C1=CC=C(C=C1)COC2=C(C=C(C=C2)CC(=O)O)Br |
InChI: | InChI=1S/C15H13BrO3/c16-13-8-12(9-15(17)18)6-7-14(13)19-10-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,17,18) |
InChI Key: | GQZFEKUVFZTZHM-UHFFFAOYSA-N |
LogP: | 3.65520 |
Publication Number | Title | Priority Date |
CN-112812112-A | Preparation method of isoquinoline alkaloid levo-corydalmine | 20191118 |
JP-2013544799-A | Compounds and compositions for cancer treatment | 20101027 |
JP-2016188247-A | Compounds and compositions for cancer treatment | 20101027 |
JP-6007186-B2 | Compounds and compositions for cancer treatment | 20101027 |
JP-6371344-B2 | Compounds and compositions for cancer treatment | 20101027 |
Complexity: | 289 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 320.00481 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 320.00481 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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