Cas no 954238-78-9 ((2-AMINO-3-FLUORO-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER)

(2-Amino-3-fluorophenyl)-carbamic acid tert-butyl ester is a fluorinated aromatic compound featuring both an amino and a protected carbamate group, making it a versatile intermediate in organic synthesis. The tert-butyl ester moiety provides stability under basic conditions while allowing selective deprotection under acidic conditions. The fluorine substituent enhances electrophilic reactivity, facilitating further functionalization. This compound is particularly useful in pharmaceutical and agrochemical research, where its structural motifs are valuable for constructing heterocycles or modifying bioactive molecules. Its well-defined reactivity profile and compatibility with common synthetic transformations make it a practical choice for targeted derivatization. Proper handling is advised due to potential sensitivity to moisture and strong acids or bases.
(2-AMINO-3-FLUORO-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER structure
954238-78-9 structure
Product Name:(2-AMINO-3-FLUORO-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER
CAS No:954238-78-9
MF:C11H15FN2O2
MW:226.247406244278
MDL:MFCD09701241
CID:822958
Update Time:2025-06-07

(2-AMINO-3-FLUORO-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER Chemical and Physical Properties

Names and Identifiers

    • (2-AMINO-3-FLUORO-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER
    • tert-Butyl (2-amino-3-fluorophenyl)carbamate
    • tert-butyl N-(2-amino-3-fluorophenyl)carbamate
    • 1,1-Dimethylethyl N-(2-amino-3-fluorophenyl)carbamate (ACI)
    • 2-Methyl-2-propanyl (2-amino-3-fluorophenyl)carbamate
    • MDL: MFCD09701241
    • Inchi: 1S/C11H15FN2O2/c1-11(2,3)16-10(15)14-8-6-4-5-7(12)9(8)13/h4-6H,13H2,1-3H3,(H,14,15)
    • InChI Key: NTMLBUWXZRGJAG-UHFFFAOYSA-N
    • SMILES: O=C(NC1C(N)=C(F)C=CC=1)OC(C)(C)C

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4

(2-AMINO-3-FLUORO-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER Pricemore >>

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(2-AMINO-3-FLUORO-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Ammonium chloride Catalysts: Iron Solvents: Ethanol ,  Water ;  12 h, 80 °C
Reference
Heterocyclic compounds for use in the treatment of cancer
, World Intellectual Property Organization, , ,

Production Method 2

Reaction Conditions
1.1 Reagents: Triethylamine Solvents: Tetrahydrofuran ;  0 °C; overnight, rt
Reference
2-Aminopyrimidine Derivatives as New Selective Fibroblast Growth Factor Receptor 4 (FGFR4) Inhibitors
Mo, Cheng; Zhang, Zhang; Guise, Christopher P.; Li, Xueqiang; Luo, Jinfeng; et al, ACS Medicinal Chemistry Letters, 2017, 8(5), 543-548

(2-AMINO-3-FLUORO-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER Raw materials

(2-AMINO-3-FLUORO-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER Preparation Products

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