Cas no 579474-49-0 (tert-Butyl (2-amino-4-chlorophenyl)carbamate)

Tert-Butyl (2-amino-4-chlorophenyl)carbamate is a protected aniline derivative widely utilized in organic synthesis and pharmaceutical research. Its key advantages include the tert-butoxycarbonyl (Boc) protecting group, which enhances stability and selectivity during reactions involving the amine functionality. The chloro substituent at the 4-position offers further reactivity for cross-coupling or substitution reactions, making it a versatile intermediate. The compound’s crystalline solid form ensures ease of handling and purification. Its compatibility with standard synthetic protocols, such as peptide coupling or palladium-catalyzed transformations, underscores its utility in constructing complex molecular architectures. Suitable for controlled deprotection under mild acidic conditions, it is a valuable tool in multistep synthesis.
tert-Butyl (2-amino-4-chlorophenyl)carbamate structure
579474-49-0 structure
Product Name:tert-Butyl (2-amino-4-chlorophenyl)carbamate
CAS No:579474-49-0
MF:C11H15ClN2O2
MW:242.702001810074
MDL:MFCD09701244
CID:2093013
PubChem ID:57456272
Update Time:2025-06-06

tert-Butyl (2-amino-4-chlorophenyl)carbamate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl (2-amino-4-chlorophenyl)carbamate
    • (2-Amino-4-chloro-phenyl)-carbamic acid tert-butyl ester
    • 1,1-Dimethylethyl N-(2-amino-4-chlorophenyl)carbamate
    • tert-Butyl(2-amino-4-chlorophenyl)carbamate
    • SCHEMBL551648
    • RAAXZOKVGWKKCP-UHFFFAOYSA-N
    • F80186
    • SB37774
    • MFCD09701244
    • EN300-1879967
    • 579474-49-0
    • (2-Amino-4-chloro-phenyl)-carbamic acid t-butyl ester
    • tert-butyl N-(2-amino-4-chlorophenyl)carbamate
    • (2-Amino-4-chloro-phenyl)-carbamic acid tert-butyl ester, AldrichCPR
    • tert-butyl 2-amino-4-chlorophenylcarbamate
    • DB-309700
    • CS-0273183
    • DTXSID701212291
    • MDL: MFCD09701244
    • Inchi: 1S/C11H15ClN2O2/c1-11(2,3)16-10(15)14-9-5-4-7(12)6-8(9)13/h4-6H,13H2,1-3H3,(H,14,15)
    • InChI Key: RAAXZOKVGWKKCP-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=C(C=1)N)NC(=O)OC(C)(C)C

Computed Properties

  • Exact Mass: 242.082
  • Monoisotopic Mass: 242.082
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 253
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.3
  • Topological Polar Surface Area: 64.4A^2

tert-Butyl (2-amino-4-chlorophenyl)carbamate Pricemore >>

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