Cas no 1255666-39-7 (tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate)

Tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate is a fluorinated piperidine derivative featuring a Boc-protected amine and a hydroxymethyl functional group. Its key structural attributes include the presence of two fluorine atoms at the 5-position, enhancing its potential as a building block in medicinal chemistry and drug discovery. The tert-butyloxycarbonyl (Boc) group provides stability and selective deprotection capabilities, while the hydroxymethyl moiety offers versatility for further functionalization. This compound is particularly valuable in the synthesis of bioactive molecules, where fluorination can influence metabolic stability and binding affinity. Its well-defined structure and reactive handles make it a useful intermediate for pharmaceutical research and fine chemical applications.
tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate structure
1255666-39-7 structure
Product Name:tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate
CAS No:1255666-39-7
MF:C11H19F2NO3
MW:251.270270586014
MDL:MFCD18433649
CID:4565129
PubChem ID:118798419
Update Time:2025-05-27

tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate
    • 5,5-Difluoro-2-hydroxymethyl-piperidine-1-carboxylic acid tert-butyl ester
    • AS-71934
    • SCHEMBL17924657
    • 1255666-39-7
    • AKOS027255568
    • tert-Butyl5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate
    • MFCD18433649
    • CS-W001710
    • MDL： MFCD18433649
    • Inchi： 1S/C11H19F2NO3/c1-10(2,3)17-9(16)14-7-11(12,13)5-4-8(14)6-15/h8,15H,4-7H2,1-3H3
    • InChI Key： NWCZKENXBRNRMY-UHFFFAOYSA-N
    • SMILES： FC1(CN(C(=O)OC(C)(C)C)C(CO)CC1)F

Computed Properties

  • Exact Mass: 251.13329979g/mol
  • Monoisotopic Mass: 251.13329979g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 289
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.7
  • Topological Polar Surface Area: 49.8

Experimental Properties

  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 311.8±42.0 °C at 760 mmHg
  • Flash Point: 142.4±27.9 °C
  • Vapor Pressure: 0.0±1.5 mmHg at 25°C

tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate Security Information

tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
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Chemenu
CM323590-1g
tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate
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abcr
AB455354-250 mg
tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate; .
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 €1,240.60 2023-04-22
Chemenu
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tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate
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SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
B940132-100mg
tert-Butyl 5,5-difluoro-2-(hydroxymethyl)piperidine-1-carboxylate
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SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
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