3-Iodo-4-methoxybenzaldehyde

Base Information

• Chemical Name: 3-Iodo-4-methoxybenzaldehyde
• CAS No.: 2314-37-6
• Molecular Formula: C8H7IO2
• Molecular Weight: 262.047
• Hs Code.: 2913000090
• European Community (EC) Number: 673-342-7
• DSSTox Substance ID: DTXSID50363475
• Nikkaji Number: J892.639E
• Wikidata: Q82147183
• Mol file: 2314-37-6.mol

Synonyms:3-iodo-4-methoxybenzaldehyde;2314-37-6;3-Iodo-4-methoxy-benzaldehyde;Benzaldehyde, 3-iodo-4-methoxy-;SCHEMBL1249811;3-iodanyl-4-methoxy-benzaldehyde;DTXSID50363475;3-Iodo-4-methoxybenzaldehyde, 97%;BBL023177;MFCD01009500;STK010409;AKOS003221110;AM86788;BENZALDEHYDE,3-IODO-4-METHOXY-;NCGC00326641-01;AC-20913;DS-16439;CS-0041339;FT-0601719;F19923;AB01320480-02;A816588

Chemical Property of 3-Iodo-4-methoxybenzaldehyde

Chemical Property:

• Vapor Pressure: 0.000237mmHg at 25°C
• Melting Point: 107-112℃
• Refractive Index: 1.633
• Boiling Point: 324.985 °C at 760 mmHg
• Flash Point: 150.346 °C
• PSA: 26.30000
• Density: 1.78 g/cm³
• LogP: 2.11230
• Storage Temp.: 2-8°C
• Sensitive.: Air & Light Sensitive
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 261.94908
• Heavy Atom Count: 11
• Complexity: 138

Purity/Quality:

97% ^*data from raw suppliers

3-Iodo-4-methoxybenzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,N
• Hazard Codes: Xn,N
• Statements: 22-50
• Safety Statements: 61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C=O)I

Technology Process of 3-Iodo-4-methoxybenzaldehyde

There total 16 articles about 3-Iodo-4-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%

diazomethane (186581-53-3,908094-01-9,334-88-3) + 4-hydroxy-3-iodo-benzaldehyde (60032-63-5) → 3-iodo-4-methoxybenzaldehyde (2314-37-6)

Guidance literature:

In diethyl ether;

DOI:10.1021/jf0510236

Reference yield: 99.0%

4-methoxy-benzaldehyde (123-11-5) → 3-iodo-4-methoxybenzaldehyde (2314-37-6)

Guidance literature:

With iodine; silver trifluoroacetate; In dichloromethane; for 24h;

DOI:10.1002/(SICI)1099-0690(200004)2000:8<1527::AID-EJOC1527>3.0.CO;2-G

Reference yield: 98.0%

(3-iodo-4-methoxyphenyl)methanol (53279-82-6) → 3-iodo-4-methoxybenzaldehyde (2314-37-6)

Guidance literature:

With sodium hydrogencarbonate; Dess-Martin periodane; In dichloromethane; for 4h;

DOI:10.1002/anie.201304923

upstream raw materials:

4-methoxy-benzaldehyde

p-methylanizole

N-<1-(3-iodo-4-methoxyphenyl)but-3-en-1-yl>-5,5-dimethoxypentanamide

4-hydroxy-3-iodo-benzaldehyde

Downstream raw materials:

3-iodo-4-methoxy-trans-cinnamic acid

trans-(4α,6α,8α,9aα)-(+/-)-4--1-(3-iodo-4-methoxyphenyl)-1-buten-3-one

4-(Bis-ethylsulfanyl-methyl)-2-iodo-phenol

4-methoxy-3-(3'-methylbut-3'-en-1'-ynyl)benzaldehyde