tert-Butyl ((2R,3S)-2-(2,5-difluorophenyl)-3,4-dihydro-2H-pyran-3-yl)carbamate


Chemical Name: tert-Butyl ((2R,3S)-2-(2,5-difluorophenyl)-3,4-dihydro-2H-pyran-3-yl)carbamate
CAS Number: 1172623-98-1
Product Number: AG000DZW(AGN-PC-0WAMC4)
Synonyms:
MDL No: MFCD28144045
Molecular Formula: C16H19F2NO3
Molecular Weight: 311.3238

Identification/Properties


Computed Properties
Molecular Weight:
311.329g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
311.133g/mol
Monoisotopic Mass:
311.133g/mol
Topological Polar Surface Area:
47.6A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
422
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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