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Home > Boronic Acids > 1704703-80-9
1704703-80-9 | (4R,8S)-8-(3-(difluoroMethyl)phenyl)-4-Methyl-2-Methylene-6-oxohexahydro-[1,3,2]oxazaborolo[2,3-b][1,3,2]oxazaborol-4-iuM-8-uide
CAS No: 1704703-80-9 Catalog No: AG00ARET MDL No:
Product Description
Catalog Number:
AG00ARET
Chemical Name:
(4R,8S)-8-(3-(difluoroMethyl)phenyl)-4-Methyl-2-Methylene-6-oxohexahydro-[1,3,2]oxazaborolo[2,3-b][1,3,2]oxazaborol-4-iuM-8-uide
CAS Number:
1704703-80-9
IUPAC Name:
(1S,5R)-1-[3-(difluoromethyl)phenyl]-5-methyl-7-methylidene-2,8-dioxa-5-azonia-1-boranuidabicyclo[3.3.0]octan-3-one
InChI:
InChI=1S/C13H14BF2NO3/c1-9-7-17(2)8-12(18)20-14(17,19-9)11-5-3-4-10(6-11)13(15)16/h3-6,13H,1,7-8H2,2H3/t14-,17-/m0/s1
InChI Key:
IIWBPBZNQLEWCJ-YOEHRIQHSA-N
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
281.103g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.066g/mol
Monoisotopic Mass:
281.103g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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