Cas no 105340-85-0 (Tert-butyl benzoyloxycarbamate)

Tert-butyl benzoyloxycarbamate is a carbamate-based compound commonly utilized as a protective group or intermediate in organic synthesis. Its key advantages include stability under various reaction conditions and selective deprotection, making it valuable in peptide and heterocycle chemistry. The tert-butyl group enhances steric protection, while the benzoyloxy moiety offers reactivity control. This compound is particularly useful in multi-step syntheses where orthogonal protection strategies are required. It demonstrates compatibility with a range of reagents, ensuring versatility in complex molecular constructions. Its well-defined cleavage properties further contribute to its utility in controlled synthetic pathways.
Tert-butyl benzoyloxycarbamate structure
105340-85-0 structure
Product Name:Tert-butyl benzoyloxycarbamate
CAS No:105340-85-0
MF:C12H15NO4
MW:237.251803636551
MDL:MFCD00599171
CID:1152432
PubChem ID:10037153
Update Time:2025-05-26

Tert-butyl benzoyloxycarbamate Chemical and Physical Properties

Names and Identifiers

    • Carbamic acid, (benzoyloxy)-, 1,1-dimethylethyl ester
    • tert-Butyl benzoyloxycarbamate
    • KMXMOOQVJSFNNK-UHFFFAOYSA-N
    • [(tert-Butoxy)carbonyl]amino benzoate
    • (Benzoyloxy)carbamic acid tert-butyl ester
    • tert-Butyl benzoyloxycarbamate, AldrichCPR
    • benzoic acid (tert-butoxycarbonylamino) ester
    • Carbamic acid, N-(benzoyloxy)-, 1,1-dimethylethyl ester
    • 105340-85-0
    • tert-Butyl (benzoyloxy)carbamate
    • AS-60074
    • AKOS027314003
    • D93365
    • SCHEMBL1948795
    • [(2-methylpropan-2-yl)oxycarbonylamino] Benzoate
    • Tert-butyl benzoyloxycarbamate
    • MDL: MFCD00599171
    • Inchi: 1S/C12H15NO4/c1-12(2,3)16-11(15)13-17-10(14)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,13,15)
    • InChI Key: KMXMOOQVJSFNNK-UHFFFAOYSA-N
    • SMILES: O(C(NOC(C1C=CC=CC=1)=O)=O)C(C)(C)C

Computed Properties

  • Exact Mass: 237.10015
  • Monoisotopic Mass: 237.10010796g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 5
  • Complexity: 277
  • 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
  • Topological Polar Surface Area: 64.599
  • XLogP3: 2.7

Experimental Properties

  • PSA: 64.63

Tert-butyl benzoyloxycarbamate Security Information

  • Hazard Category Code: 36/37/38
  • Safety Instruction: 26
  • Hazardous Material Identification: Xi

Tert-butyl benzoyloxycarbamate Pricemore >>

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