4-(Benzyloxy)-2-fluorobenzaldehyde

Base Information

• Chemical Name: 4-(Benzyloxy)-2-fluorobenzaldehyde
• CAS No.: 504414-32-8
• Molecular Formula: C14H11FO2
• Molecular Weight: 230.239
• DSSTox Substance ID: DTXSID50478290
• Mol file: 504414-32-8.mol

Synonyms:4-(Benzyloxy)-2-fluorobenzaldehyde;504414-32-8;2-fluoro-4-phenylmethoxybenzaldehyde;Benzaldehyde, 2-fluoro-4-(phenylmethoxy)-;MFCD12025062;SCHEMBL742149;4-Benzyloxy-2-fluorobenzaldehyde;DTXSID50478290;4-benzyloxy-2-fluoro benzaldehyde;4-benzyloxy-2-fluoro-benzaldehyde;KRCUZBWXZUPORH-UHFFFAOYSA-N;CL9348;AKOS016003025;2-Fluoro-4-(phenylmethoxy)-benzaldehyde;AC-30528;DS-17460;SY114769;CS-0135760

Chemical Property of 4-(Benzyloxy)-2-fluorobenzaldehyde

Chemical Property:

• PSA: 26.30000
• LogP: 3.21720
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 230.07430775
• Heavy Atom Count: 17
• Complexity: 238

Purity/Quality:

98% ^*data from raw suppliers

4-(Benzyloxy)-2-fluorobenzaldehyde 98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=CC(=C(C=C2)C=O)F

Technology Process of 4-(Benzyloxy)-2-fluorobenzaldehyde

There total 5 articles about 4-(Benzyloxy)-2-fluorobenzaldehyde 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: 94.4%

2-fluoro-4-hydroxybenzaldehyde (348-27-6) + benzyl bromide (100-39-0) → 4-(benzyloxy)-2-fluorobenzaldehyde (504414-32-8)

Guidance literature:

With caesium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 72h;

Reference yield: 94.4%

→ 4-(benzyloxy)-2-fluorobenzaldehyde (504414-32-8)

Guidance literature:

Reference yield: 88.0%

2-fluoro-4-phenylmethoxybenzonitrile (185836-35-5) → 4-(benzyloxy)-2-fluorobenzaldehyde (504414-32-8)

Guidance literature:

With diisobutylaluminium hydride; In hexanes; dichloromethane; at -78 - 20 ℃; for 1h;

upstream raw materials:

2-fluoro-4-phenylmethoxybenzonitrile

2-fluoro-4-hydroxybenzaldehyde

benzyl bromide

4-benzyloxy-2-fluoro-benzyl alcohol

Downstream raw materials:

[11-(4-benzyloxy-2-fluoro-phenyl)-3,3-dimethyl-1,1-dioxo-2,3,4,5,10,11-hexahydro-1H-1 λ6-thia-5,10-diaza-dibenzo[a,d]cyclohepten-6-yl]-carbamic acid 9H-fluoren-9-ylmethyl ester

C₂₈H₂₉FN₂O₄S

C₂₈H₂₉FN₂O₄S

11-(4-benzyloxy-2-fluorophenyl)-6-hydroxy-3,3-dimethyl-1,1-dioxo-1,2,3,4,5,11-hexahydro-1λ6-thia-5,10-diazadibenzo[a,d]cycloheptene

Refernces

• 1、 -. "6-HYDROXY-DIBENZODIAZEPINONES USEFUL AS HEPATITIS C VIRUS INHIBITORS". Page/Page column 74-75. . Retrieved 2008/12/08.
• 2、 -. "1,1-DIOXO-1-THIA-5,10-DIAZADIBENZOCYCLOHEPTENES USEFUL AS HEPATITIS C VIRUS INHIBITORS". Page/Page column 49-50. . Retrieved 2008/12/08.