CAS 836619-77-3

1,1-Dimethylethyl N-(3-bromo-4-fluorophenyl)carbamate

Description:

1,1-Dimethylethyl N-(3-bromo-4-fluorophenyl)carbamate, with the CAS number 836619-77-3, is a chemical compound characterized by its carbamate functional group, which is derived from the reaction of an amine with a carbonic acid derivative. This compound features a tert-butyl group (1,1-dimethylethyl) that enhances its lipophilicity and stability. The presence of the 3-bromo-4-fluorophenyl moiety introduces halogen substituents that can influence the compound's reactivity and biological activity. Typically, compounds like this may exhibit properties such as moderate solubility in organic solvents and potential applications in pharmaceuticals or agrochemicals due to their ability to interact with biological systems. The specific arrangement of atoms and functional groups in this compound suggests it may participate in various chemical reactions, including nucleophilic substitutions or hydrolysis, depending on the conditions. Overall, the unique combination of structural features in 1,1-Dimethylethyl N-(3-bromo-4-fluorophenyl)carbamate contributes to its potential utility in diverse chemical applications.

Formula: C₁₁H₁₃BrFNO₂

InChI: InChI=1S/C11H13BrFNO2/c1-11(2,3)16-10(15)14-7-4-5-9(13)8(12)6-7/h4-6H,1-3H3,(H,14,15)

InChI key: InChIKey=XPHQSYXWFLVFDU-UHFFFAOYSA-N

SMILES: N(C(OC(C)(C)C)=O)C1=CC(Br)=C(F)C=C1

Synonyms:

• Carbamic acid, (3-bromo-4-fluorophenyl)-, 1,1-dimethylethyl ester
• Carbamic acid, N-(3-bromo-4-fluorophenyl)-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl N-(3-bromo-4-fluorophenyl)carbamate
• tert-Butyl (3-bromo-4-fluorophenyl)carbamate

tert-Butyl (3-bromo-4-fluorophenyl)carbamate

CAS: 836619-77-3

Formula: C₁₁H₁₃BrFNO₂

Purity: 97%

Color and Shape: Solid

Molecular weight: 290.1288

Ref: IN-DA003ST3

tert-Butyl (3-bromo-4-fluorophenyl)carbamate

CAS: 836619-77-3

tert-Butyl (3-bromo-4-fluorophenyl)carbamate

Purity: 97%

Molecular weight: 290.132g/mol

Ref: 54-PC99751

tert-Butyl (3-bromo-4-fluorophenyl)carbamate

CAS: 836619-77-3

Formula: C₁₁H₁₃BrFNO₂

Purity: 97%

Molecular weight: 290.132

Ref: 10-F447151

N-Boc-3-bromo-4-fluoroaniline

CAS: 836619-77-3

N-Boc-3-bromo-4-fluoroaniline is an electrophilic compound that has a postulated use in the synthesis of medicinally active compounds. The yield of this product can be increased by removing the boc group with methanol and then deprotecting with chloride. This compound is structurally similar to other electrophiles, such as 3-bromo-4-chloroaniline, which has been used as an inhibitor. N-Boc-3-bromo-4-fluoroaniline’s postulated use is similar to that of 3,5,6,-trimethylaniline, which has been used as a substrate for synthetic reactions.

Formula: C₁₁H₁₃BrFNO₂

Purity: Min. 95%

Molecular weight: 290.13 g/mol

Ref: 3D-LIB61977