5-Bromo-2-methoxybenzaldehyde

Base Information

• Chemical Name: 5-Bromo-2-methoxybenzaldehyde
• CAS No.: 25016-01-7
• Molecular Formula: C8H7BrO2
• Molecular Weight: 215.046
• Hs Code.: 29130000
• European Community (EC) Number: 246-564-3
• NSC Number: 41186
• DSSTox Substance ID: DTXSID10179716
• Nikkaji Number: J149.811H
• Wikidata: Q72451406
• Mol file: 25016-01-7.mol

Synonyms:5-Bromo-2-methoxybenzaldehyde;25016-01-7;5-Bromo-2-anisaldehyde;5-Bromo-o-anisaldehyde;Benzaldehyde, 5-bromo-2-methoxy-;2-Methoxy-5-bromobenzaldehyde;MFCD00003347;EINECS 246-564-3;Tributyltinazide;5-bromo-2-methoxy-benzaldehyde;NSC41186;o-Anisaldehyde, 5-bromo-;5-bromo-2 methoxybenzaldehyde;SCHEMBL153974;5-Bromo-2-anisaldehyde(5-Bromo-2-methoxybenzaldehyde);IJIBRSFAXRFPPN-UHFFFAOYSA-;DTXSID10179716;BCP27468;CS-M0570;STR06720;NSC 41186;NSC-41186;STK198751;5-Bromo-2-methoxybenzaldehyde, 99%;AKOS000119546;AC-3825;SY015223;AM20040013;B1791;FT-0620100;EN300-16119;AD-266/40988996;J-015774;Z53834334;F3098-7680

Chemical Property of 5-Bromo-2-methoxybenzaldehyde

Chemical Property:

• Appearance/Colour: Light yellow crystalline powder
• Vapor Pressure: 0.00224mmHg at 25°C
• Melting Point: 116-119 °C(lit.)
• Refractive Index: 1.585
• Boiling Point: 289.1 °C at 760 mmHg
• Flash Point: 128.7 °C
• PSA: 26.30000
• Density: 1.522 g/cm³
• LogP: 2.27020
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Sensitive.: Air Sensitive
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 213.96294
• Heavy Atom Count: 11
• Complexity: 138

Purity/Quality:

97% ^*data from raw suppliers

5-Bromo-2-methoxybenzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,Xn
• Statements: 36/37/38-22
• Safety Statements: 24/25

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)Br)C=O
• Uses: 5-Bromo-2-methoxybenzaldehyde was used in the preparation of trans-5-bromo-2-methoxybenzylidenecyanoacetic acid.

Technology Process of 5-Bromo-2-methoxybenzaldehyde

There total 19 articles about 5-Bromo-2-methoxybenzaldehyde which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

5-bromosalicyclaldehyde (1761-61-1) + methyl iodide (74-88-4) → 5-bromo-2-methoxybenzaldehyde (25016-01-7)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; Inert atmosphere;

DOI:10.1021/acs.jmedchem.9b00219

Reference yield: 97.0%

5-bromo-2-methoxy-benzyl alcohol (80866-82-6) → 5-bromo-2-methoxybenzaldehyde (25016-01-7)

Guidance literature:

With dmap; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; copper diacetate; In neat (no solvent); at 80 ℃; for 18h; Green chemistry;

DOI:10.1039/c4ra09851j

Reference yield: 95.0%

dimethyl sulfate (77-78-1) + 5-bromosalicyclaldehyde (1761-61-1) → 5-bromo-2-methoxybenzaldehyde (25016-01-7)

Guidance literature:

With potassium carbonate; In acetone; for 2h;

DOI:10.1016/S0040-4039(98)00186-5

upstream raw materials:

4-bromo-2-(chloromethyl)-1-methoxybenzene

ortho-anisaldehyde

dimethyl sulfate

5-bromosalicyclaldehyde

Downstream raw materials:

5-bromo-2'-hydroxy-2-methoxy-5'-nitro-trans-chalcone

(E)-3-(5-Bromo-2-methoxyphenyl)acrylic acid

1-(4-bromo-1-hydroxy-[2]naphthyl)-3t-(5-bromo-2-methoxy-phenyl)-propenone