tert-Butyl 2-fluoro-3-acetoxypropylcarbamate

HCID 6420719

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Basic information

CAS: 648900-67-8
Standard SMILES: CC(=O)OCC(F)CNC(=O)OC(C)(C)C
InChIKey: BFSDDVRCOZXUMV-UHFFFAOYSA-N
Molecular formula: C10H18FNO4
Average molar mass: 235.25 g/mol
Monoisotopic mass: 235.12198628

Names & identifiers

Preferred name: tert-Butyl 2-fluoro-3-acetoxypropylcarbamate
IUPAC: [2-fluoro-3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] acetate

Names & synonyms

tert-Butyl 2-fluoro-3-acetoxypropylcarbamate648900-67-8DTXSID70423585BFSDDVRCOZXUMV-UHFFFAOYSA-NCarbamic acid, [3-(acetyloxy)-2-fluoropropyl]-, 1,1-dimethylethyl ester3-[(TERT-BUTOXYCARBONYL)AMINO]-2-FLUOROPROPYL ACETATE

Database identifiers

CAS: 648900-67-8
PubChem CID: 6420719
DTXSID: DTXSID70423585
Nikkaji: J1.865.693K

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 64.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 16
Formal charge: 0
Complexity: 250

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