4-ISOPROPOXYBENZALDEHYDE
- Product Name
- 4-ISOPROPOXYBENZALDEHYDE
- CAS No.
- 18962-05-5
- Chemical Name
- 4-ISOPROPOXYBENZALDEHYDE
- Synonyms
- NSC 69072;AKOS 226-45;AKOS BC-2523;AKOS B000275;ALDH1A3-IN-3;ASISCHEM R42745;BUTTPARK 32\08-27;4-IsopropoxybenzaL;4-ISOPROPOXYBENZALDEHYDE;p-Isopropoxybenzaldehyde
- CBNumber
- CB9318261
- Molecular Formula
- C10H12O2
- Formula Weight
- 164.2
- MOL File
- 18962-05-5.mol
4-ISOPROPOXYBENZALDEHYDE Property
- Melting point:
- 167 °C
- Boiling point:
- 108-110 °C (5 mmHg)
- Density
- 1.036
- refractive index
- 1.545-1.547
- Flash point:
- 108-110°C/5mm
- storage temp.
- under inert gas (nitrogen or Argon) at 2-8°C
- form
- clear liquid
- color
- Colorless to Light orange to Yellow
- Sensitive
- Air Sensitive
- BRN
- 742921
- InChI
- InChI=1S/C10H12O2/c1-8(2)12-10-5-3-9(7-11)4-6-10/h3-8H,1-2H3
- InChIKey
- WDANSDASCKBVKH-UHFFFAOYSA-N
- SMILES
- C(=O)C1=CC=C(OC(C)C)C=C1
- CAS DataBase Reference
- 18962-05-5(CAS DataBase Reference)
Safety
- Hazard Codes
- Xi
- Risk Statements
- 36/37/38
- Safety Statements
- 37/39-26-36
- HazardClass
- IRRITANT
- HS Code
- 2912490090
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405Store locked up.
N-Bromosuccinimide Price
- Product number
- I0949
- Product name
- 4-Isopropoxybenzaldehyde
- Purity
- >96.0%(GC)
- Packaging
- 5g
- Price
- $48
- Updated
- 2025/07/31
- Product number
- I0949
- Product name
- 4-Isopropoxybenzaldehyde
- Purity
- >96.0%(GC)
- Packaging
- 25g
- Price
- $167
- Updated
- 2025/07/31
- Product number
- I779023
- Product name
- 4-Isopropoxybenzaldehyde
- Packaging
- 250mg
- Price
- $45
- Updated
- 2021/12/16
- Product number
- J52199
- Product name
- 4-Isopropoxybenzaldehyde
- Packaging
- 1g
- Price
- $10
- Updated
- 2021/12/16
- Product number
- 028456
- Product name
- 4-Isopropoxybenzaldehyde
- Purity
- 95+%
- Packaging
- 5g
- Price
- $17
- Updated
- 2021/12/16
4-ISOPROPOXYBENZALDEHYDE Chemical Properties,Usage,Production
Chemical Properties
clear colorless to yellow liquid
Uses
ALDH1A3-IN-3 (compound 16) is a potent inhibitor of ALDH1A3, with an IC50 of 0.26 μM. ALDH1A3-IN-3 is also a good ALDH3A1 substrate. ALDH1A3-IN-3 can be used for the research of prostate cancer[1].
Synthesis
75-30-9
123-08-0
18962-05-5
General procedure for the synthesis of 4-isopropoxybenzaldehyde from 2-iodopropane and p-hydroxybenzaldehyde: Referring to Example 3, to a 100 mL DMF solution containing 2 g (16.38 mmol) of p-hydroxybenzaldehyde was added sequentially 2.72 g (19.69 mmol) of K2CO3, 2.74 g (16.52 mmol) of KI, and 3.94 mL ( 39.38 mmol) 2-iodopropane and the reaction was carried out under argon protection. The reaction mixture was stirred at 80 °C overnight and subsequently concentrated. The concentrated residue was partitioned between CHCl3 and H2O to separate the organic and aqueous phases. The aqueous phase was further extracted with CHCl3 and after combining all the organic phases was dried and concentrated with MgSO4. The crude product was purified by silica gel column chromatography using a gradient polarity EtOAc/hexane mixed solvent as eluent, resulting in 2.08 g of oily 4-isopropoxybenzaldehyde in 77% yield. The structure of the product was confirmed by 1H-NMR (300 MHz, CDCl3, δTMS): 1.39 (d, J=6Hz, 6H), 4.67 (m, 1H), 6.96 (d, J=8.7Hz, 2H), 7.81 (d, J=8.7Hz, 2H), 9.87 (s, 1H).
IC 50
ALDH3; ALDH1
References
[1] Ibrahim AIM, et, al. Expansion of the 4-(Diethylamino)benzaldehyde Scaffold to Explore the Impact on Aldehyde Dehydrogenase Activity and Antiproliferative Activity in Prostate Cancer. J Med Chem. 2022 Mar 10;65(5):3833-3848. DOI:10.1021/acs.jmedchem.1c01367
4-ISOPROPOXYBENZALDEHYDE Preparation Products And Raw materials
Raw materials
Preparation Products
4-ISOPROPOXYBENZALDEHYDE Suppliers
- Tel
- 03-36680489
- Fax
- 03-3668-0520
- Sales-JP@TCIchemicals.com
- Country
- Japan
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- Advantage
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View Lastest Price from 4-ISOPROPOXYBENZALDEHYDE manufacturers
- Product
- 4-ISOPROPOXYBENZALDEHYDE 18962-05-5
- Price
- US $15.00-10.00/KG
- Min. Order
- 1KG
- Purity
- 99%+ HPLC
- Supply Ability
- Monthly supply of 1 ton
- Release date
- 2021-07-11
- Product
- 4-ISOPROPOXYBENZALDEHYDE 18962-05-5
- Price
- US $15.00-10.00/KG
- Min. Order
- 1KG
- Purity
- 99%+ HPLC
- Supply Ability
- Monthly supply of 1 ton
- Release date
- 2021-07-09
- Product
- 4-(Isopropyloxy)benzaldehyde 18962-05-5
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 98%
- Supply Ability
- 200KG
- Release date
- 2020-01-09