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Home > Boronic Acids > 77855-51-7
77855-51-7 | boron 2,4-dimethoxybenzenediazonium fluoride(1:1:4)
CAS No: 77855-51-7 Catalog No: AG008O8C MDL No:
Product Description
Catalog Number:
AG008O8C
Chemical Name:
boron 2,4-dimethoxybenzenediazonium fluoride(1:1:4)
CAS Number:
77855-51-7
Molecular Formula:
C8H9BF4N2O2
Molecular Weight:
251.9739
IUPAC Name:
2-hydroxy-N-(1-phenylethyl)propanamide
InChI:
InChI=1S/C11H15NO2/c1-8(12-11(14)9(2)13)10-6-4-3-5-7-10/h3-9,13H,1-2H3,(H,12,14)
InChI Key:
HLBWSYNCXWWEKN-UHFFFAOYSA-N
SMILES:
COc1cc(OC)ccc1[N+]#N.[F-].[F-].[F-].[F-].[B+3]
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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