CAS 1372096-37-1: 1,1-Dimethylethyl N-[(3-fluoro-4-formylphenyl)methyl]carbamate

Description: 1,1-Dimethylethyl N-[(3-fluoro-4-formylphenyl)methyl]carbamate, identified by its CAS number 1372096-37-1, is a chemical compound that features a carbamate functional group, which is characterized by the presence of a carbonyl group (C=O) bonded to a nitrogen atom (N) that is also connected to an alkyl or aryl group. This compound includes a dimethyl substituent, contributing to its steric bulk, and a fluoro-substituted phenyl group, which can influence its reactivity and biological activity. The presence of the formyl group (–CHO) on the phenyl ring suggests potential for further chemical reactivity, particularly in nucleophilic addition reactions. The overall structure indicates that it may exhibit interesting properties, such as solubility in organic solvents and potential applications in pharmaceuticals or agrochemicals. Its specific characteristics, including melting point, boiling point, and solubility, would require empirical measurement or literature reference for precise values. Safety data and handling precautions should also be consulted, as with any chemical substance.

Formula: C₁₃H₁₆FNO₃

InChI: InChI=1S/C13H16FNO3/c1-13(2,3)18-12(17)15-7-9-4-5-10(8-16)11(14)6-9/h4-6,8H,7H2,1-3H3,(H,15,17)

InChI key: InChIKey=BXEXCMXXYGSEJZ-UHFFFAOYSA-N

SMILES: O=CC1=CC=C(C=C1F)CNC(=O)OC(C)(C)C

Synonyms:

• 1,1-Dimethylethyl N-[(3-fluoro-4-formylphenyl)methyl]carbamate
• Carbamic acid, N-[(3-fluoro-4-formylphenyl)methyl]-, 1,1-dimethylethyl ester

Tert-butyl n-[(3-fluoro-4-formylphenyl)methyl]carbamate

CAS: 1372096-37-1

• Purity: 95%
• Molecular weight: 253.2729949951172

5-2-Formylfluorobenzene

CAS: 1372096-37-1

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• Formula: C₁₃H₁₆FNO₃
• Purity: Min. 95%
• Molecular weight: 253.27 g/mol