(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-indol-3-yl)boronic acid | CAS No. 181365-26-4
(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-indol-3-yl)boronic acid
Basic Information
CAS Number
181365-26-4
Molecular Formula
C13H16BNO4
Molecular Weight
261.09 g/mol
AD
Chemical Classification
Basic Physical Properties
Safety Information
View Safety InformationHazard Statement
H315
Causes skin irritation
Skin corrosion/irritation
Skin corrosion/irritation
H319
Causes serious eye irritation
Serious eye damage/eye irritation
Serious eye damage/eye irritation
H335
May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation
Synonyms & References
English
- AKOS004116600
- {1-[(tert-butoxy)carbonyl]-1H-indol-3-yl}boronic acid
- CS-W003297
- [1-(tert-butoxycarbonyl)-1H-indol-3-yl]boronic acid
- (1-tert-Butoxycarbonylindol-3-yl)boronic acid
- EN300-87108
- SCHEMBL966206
- 1-(TERT-BUTOXYCARBONYL)INDOLE-3-BORONICACID
- 181365-26-4
- AS-17936
- A880996
- 1H-INDOLE-1-CARBOXYLIC ACID, 3-BORONO-, 1-(1,1-DIMETHYLETHYL) ESTER
- 1-(t-butyloxycarbonyl)-3-indoleboronic acid
- UAGJZZDMFOTJRN-UHFFFAOYSA-N
- 1-BOC-indole-3-yl-boronic acid
- [1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]boronic Acid
- 1-(TERT-BUTOXYCARBONYL)-1H-INDOL-3-YLBORONIC ACID
- 1-(TERT-BUTOXYCARBONYL)INDOL-3-YLBORONIC ACID
- AB25475
- SY007059
- (1-(tert-Butoxycarbonyl)-1H-indol-3-yl)boronic acid
- (1-(tert-Butoxycarbonyl)-1H-indol-3-yl)boronicacid
- 1-(tert-Butoxycarbonyl)Indole-3-boronic acid
- C13H16BNO4
- 1-Boc-indole-3-boronic Acid
- AM80910
- MFCD06656257
- 1 week
- 1-(TERT-BUTOXYCARBONYL)INDOLE-3-BORONIC ACID
- 1-BOC-INDOLE-3-BORONIC ACID
- 1H-Indole-1-carboxylic acid, 3-borono-, 1-(1,1-dimethylethyl) ester
MDL Number
MFCD06656257
FAQ
What are the physical and chemical properties of (1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-indol-3-yl)boronic acid (CAS: 181365-26-4)?
The compound (1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-indol-3-yl)boronic acid (CAS: 181365-26-4) is a solid with a crystalline form. Its molecular weight is approximately 352.38 g/mol. The compound is slightly soluble in water but has better solubility in organic solvents like methanol and ethanol. It is reactive towards nucleophiles and can participate in various organic reactions such as esterification and nucleophilic substitution. It has a melting point around 160-165°C.
How is (1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-indol-3-yl)boronic acid (CAS: 181365-26-4) typically synthesized?
(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-indol-3-yl)boronic acid (CAS: 181365-26-4) is synthesized through a multistep process involving the protection of the indole nitrogen, esterification, and subsequent deprotection. Common methods include using tert-butyloxycarbonyl (Boc) protection for the indole nitrogen followed by esterification with a 2-methyl-2-propanol derivative. The final step involves boronation using a boronic acid ester reagent and a palladium catalyst under mild conditions. The overall yield is typically around 70-80%.
What industries use (1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-indol-3-yl)boronic acid (CAS: 181365-26-4)?
The compound (1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-indol-3-yl)boronic acid (CAS: 181365-26-4) finds application in the pharmaceutical industry for the synthesis of drug intermediates. It is also utilized in polymer synthesis, where it can serve as a functional monomer to introduce specific chemical functionalities. Additionally, it is used in the development of new materials and sensors due to its unique structural and chemical properties.
What precautions should be taken when handling (1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-indol-3-yl)boronic acid (CAS: 181365-26-4)?
When handling (1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-indol-3-yl)boronic acid (CAS: 181365-26-4), it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be cleaned up immediately using a suitable absorbent material and disposed of according to local regulations. Always refer to the safety data sheet (SDS) for detailed handling and disposal information. Ensure the compound is stored in a cool, dry place, away from direct sunlight and flammable materials.
Related Compounds
![N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure](https://static.chemtradehub.com/structs/103/103687-96-3-8086.webp "N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure")
N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine
CAS Number:
103687-96-3
Molecular Formula:
C17H19NO5S
![5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure](https://static.chemtradehub.com/structs/112/112897-99-1-d1f4.webp "5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure")
5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine
CAS Number:
112897-99-1
Molecular Formula:
C30H31N3O7
![(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure](https://static.chemtradehub.com/structs/121/121055-10-5-583d.webp "(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure")
(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile
CAS Number:
121055-10-5
Molecular Formula:
C17H17NO4
![Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure](https://static.chemtradehub.com/structs/126/1263059-26-2-d6da.webp "Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure")
Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate
CAS Number:
1263059-26-2
Molecular Formula:
C8H6ClN3O2
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