1-Bromo-2-naphthoic acid - CAS 20717-79-7
Catalog: |
BB016215 |
Product Name: |
1-Bromo-2-naphthoic acid |
CAS: |
20717-79-7 |
Synonyms: |
1-bromonaphthalene-2-carboxylic acid |
IUPAC Name: | 1-bromonaphthalene-2-carboxylic acid |
Description: | 1-Bromo-2-naphthoic acid (CAS# 20717-79-7) is a useful research chemical. |
Molecular Weight: | 251.08 |
Molecular Formula: | C11H7BrO2 |
Canonical SMILES: | C1=CC=C2C(=C1)C=CC(=C2Br)C(=O)O |
InChI: | InChI=1S/C11H7BrO2/c12-10-8-4-2-1-3-7(8)5-6-9(10)11(13)14/h1-6H,(H,13,14) |
InChI Key: | VUVIRKAVBZITDO-UHFFFAOYSA-N |
Boiling Point: | 372.7 °C / 760 mmHg |
Purity: | 99 % |
Density: | 1.648 g/cm3 |
Appearance: | Yellow to tan powder |
Storage: | Sealed in dry. Room temperature. |
MDL: | MFCD00021408 |
LogP: | 3.30050 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3796975-A1 | Sulfinylaminobenzamide and sulfonylaminobenzamide derivatives | 20180522 |
EP-3686201-A1 | Influenza virus replication inhibitor and use thereof | 20170918 |
US-2020283454-A1 | Influenza virus replication inhibitor and use thereof | 20170918 |
WO-2017174414-A1 | Naphthaline-derivatives as pest control agents | 20160405 |
EP-3358346-A1 | Enantiomer analysis method | 20151002 |
PMID | Publication Date | Title | Journal |
19939518 | 20100201 | Identification and characterisation of new inhibitors for the human hematopoietic prostaglandin D2 synthase | European journal of medicinal chemistry |
21578959 | 20091128 | Methyl 1-bromo-2-naphthoate | Acta crystallographica. Section E, Structure reports online |
18220445 | 20080601 | Vapor pressures and thermodynamics of oxygen-containing polycyclic aromatic hydrocarbons measured using Knudsen effusion | Environmental toxicology and chemistry |
16327185 | 20051201 | Synthesis and cytotoxic activity of acronycine analogues in the benzo[c]pyrano[3,2-h]acridin-7-one and naphtho[1,2-b][1,7] and [1,10]-phenanthrolin-7(14H)-one series | Chemical & pharmaceutical bulletin |
Complexity: | 229 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 249.96294 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 249.96294 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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