17610-00-3

Basic information

• Product Name: 3,5-Bis(tert-butyl)benzaldehyde
• Synonyms: RARECHEM AQ A2 0001;3,5-BIS(TERT-BUTYL)BENZALDEHYDE;3,5-DI-TERT-BUTYL-BENZALDEHYDE;3,5-BIS(TERT-BUTYL)BENZALDEHYDE 97%;3,5-BIS(TERT-BUTYL)BENZLDEHYDE;3,5-Bis(tert-butyl)benzaldehyde,97%;3,5-Bis(tert-butyl)benzaldehyde3,5-Di-tert-butylbenzaldehyde;3,5-Di-tert-butylbenzaldehyle
• CAS NO: 17610-00-3
• Molecular Formula: C₁₅H₂₂O
• Molecular Weight: 218.33
• EINECS: 1592732-453-0
• Product Categories: Aldehydes;Phenyls & Phenyl-Het;Porphyrins;Phenyls & Phenyl-Het;Building Blocks;C13-C60;Carbonyl Compounds;Chemical Synthesis;Organic Building Blocks
• Mol File: 17610-00-3.mol
• Article Data: 39

Chemical Properties

• Melting Point: 85-89 °C(lit.)
• Boiling Point: 132°C/5mmHg(lit.)
• Flash Point: 52.7 °C
• Appearance: off-white powder
• Density: 0.9445 (rough estimate)
• Vapor Pressure: 1.38E-07mmHg at 25°C
• Refractive Index: 1.5410 (estimate)
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Solubility: soluble in Methanol
• CAS DataBase Reference: 3,5-Bis(tert-butyl)benzaldehyde(CAS DataBase Reference)
• NIST Chemistry Reference: 3,5-Bis(tert-butyl)benzaldehyde(17610-00-3)
• EPA Substance Registry System: 3,5-Bis(tert-butyl)benzaldehyde(17610-00-3)

Safety Data

• Safety Statements: 22-24/25
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 17610-00-3(Hazardous Substances Data)

Usage

Chemical Properties

off-white powder

Uses

3,5-Di-tert-butylbenzaldehyde may be used in the synthesis of the following:5-p-pyridyl-15-(3,5-di-tert-butylphenyl)porphyrin via condensation reaction with 4-pyridinecarboxaldehyde and 2,2′-dipyrrylmethane3,5-di-tert-butylphenyl-dipyrromethane via reaction with pyrrole in the presence of trifluoroacetic acid3,5-di-tert-butyl-2-nitrobenzaldehyde via nitration reaction

InChI:InChI=1/C16H20BrNO2/c17-11-7-3-1-2-4-8-12-18-15(19)13-9-5-6-10-14(13)16(18)20/h5-6,9-10H,1-4,7-8,11-12H2

Upstream product

• 62938-08-3 3,5-di-tert-butylbenzyl bromide 
• 201230-82-2 carbon monoxide 
• 155064-25-8 3,5-bis(1,1-dimethylethyl)phenyl trifluoromethanesulfonate 
• 873056-39-4 phosphoric acid 2,4-di-tert-butyl-phenyl ester diethyl ester 
• 96-76-4 2,4-di-tert-Butylphenol 
• 4885-02-3 Dichloromethyl methyl ether 
• 1014-60-4 1,3-di-tert-butylbenzene 
• 100-97-0 hexamethylenetetramine 
• 22385-77-9 1-bromo-3,5-di-tert-butylbenzene 
• 68-12-2 N,N-dimethyl-formamide 
• 16225-26-6 3,5-di-tert-butylbenzoic acid 
• 108-88-3 toluene 
• 77387-57-6 3,5-bis(1,1-dimethylethyl)benzenemethanol 
• 62938-09-4 1,3-Di-tert-butyl-5-phenylsulfanylmethyl-benzene 

Downstream Products

• 84182-79-6 cis-2,6-Bis<3,5-bis(1,1-dimethylethyl)phenyl>-4-piperidinon 
• 111439-56-6 3.5-Di-tert.-butyl-benzhydrol 
• 184003-54-1 3,5-Di-tert-butyl-benzaldehyde O-methyl-oxime 
• 133348-89-7 (E)-4-[2-(3,5-di-tert-butylphenyl)vinyl]benzonitrile 
• 89372-90-7 5,10,15,20-tetrakis-(3,5-di-tert-butylphenyl)porphyrin 
• 864249-63-8 (3,5-di-tert-butyl-benzyl)-(6-hydroxy-hexyl)-carbamic acid tert-butyl ester 

Relevant articles and documents

Synthesis and photophysics of porphyrin-fullerene donor-acceptor dyads with conformationally flexible linkers

The synthesis and photophysics of a series of porphyrin-fullerene (P-C 60) dyads in which the two chromophores are linked by conformationally flexible polyether chains is reported. Molecular modeling indicates the two moieties adopt a stacked c

Selective Electrochemical Oxygenation of Alkylarenes to Carbonyls

An efficient electrochemical method for benzylic C(sp3)-H bond oxidation has been developed. A variety of methylarenes, methylheteroarenes, and benzylic (hetero)methylenes could be converted into the desired aryl aldehydes and aryl ketones in moderate to excellent yields in an undivided cell, using O2 as the oxygen source and lutidinium perchlorate as an electrolyte. On the basis of cyclic voltammetry studies, 18O labeling experiments, and radical trapping experiments, a possible single-electron transfer mechanism has been proposed for the electrooxidation reaction.

Accepting to Donate: NDI-Based Small Molecule as a Donor for Bulk Heterojunction Binary Solar Cells

A small molecular D-π-A-π-D triad NDIP consisting of naphthalenediimide (NDI) as an acceptor and porphyrin as a donor was synthesized. NDIP exhibits an intense absorption from visible to NIR region (400 nm to 1000 nm) with high molecular extinction coefficient. Endowed with excellent absorption and good charge carrier mobility, the molecule was used as a donor, against the normal perception as an acceptor due to the electron-deficient nature of NDI, in the binary bulk heterojunction solar cells with PCBM as an acceptor. The cell demonstrated remarkable power conversion efficiency of 8.45 % with extremely low Eloss of 0.40 eV, which is also the best recorded for NDI based small molecule organic solar cells.