5-(Benzyloxy)-2-nitrophenylacetic Acid - CAS 6855-55-6
Catalog: |
BB033582 |
Product Name: |
5-(Benzyloxy)-2-nitrophenylacetic Acid |
CAS: |
6855-55-6 |
Synonyms: |
2-(2-nitro-5-phenylmethoxyphenyl)acetic acid; 2-(2-nitro-5-phenylmethoxyphenyl)acetic acid |
IUPAC Name: | 2-(2-nitro-5-phenylmethoxyphenyl)acetic acid |
Description: | 5-(Benzyloxy)-2-nitrophenylacetic Acid (CAS# 6855-55-6 ) is a useful research chemical. |
Molecular Weight: | 287.27 |
Molecular Formula: | C15H13NO5 |
Canonical SMILES: | C1=CC=C(C=C1)COC2=CC(=C(C=C2)[N+](=O)[O-])CC(=O)O |
InChI: | InChI=1S/C15H13NO5/c17-15(18)9-12-8-13(6-7-14(12)16(19)20)21-10-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,17,18) |
InChI Key: | GWEWXLWLWFDHJO-UHFFFAOYSA-N |
LogP: | 3.32410 |
Publication Number | Title | Priority Date |
EP-1762218-A1 | 4-aminophenol derivatives and colorants comprising these compounds | 20050830 |
US-2007067922-A1 | 4-Aminophenol derivatives and colorants comprising these compounds | 20050830 |
WO-2007026313-A2 | 4-aminophenol derivatives and colorants comprising these compounds | 20050830 |
TW-474811-B | Novel thiazolyl benzofuran derivatives having activities as leukotriene and srs-a antagonists or inhibitors and the pharmaceutical composition thereof | 19960412 |
CA-2244189-A1 | Thiazolylbenzofuran derivatives and pharmaceutical compositions containing them | 19960122 |
Complexity: | 362 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 287.07937252 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 287.07937252 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 92.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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