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Home > Boronic Acids > 1704074-45-2
1704074-45-2 | (3-(4-ethylpiperazin-1-yl)-5-fluorophenyl)boronic acid
CAS No: 1704074-45-2 Catalog No: AG00AR8X MDL No:MFCD28400380
Product Description
Catalog Number:
AG00AR8X
Chemical Name:
(3-(4-ethylpiperazin-1-yl)-5-fluorophenyl)boronic acid
CAS Number:
1704074-45-2
MDL Number:
MFCD28400380
IUPAC Name:
[3-(4-ethylpiperazin-1-yl)-5-fluorophenyl]boronic acid
InChI:
InChI=1S/C12H18BFN2O2/c1-2-15-3-5-16(6-4-15)12-8-10(13(17)18)7-11(14)9-12/h7-9,17-18H,2-6H2,1H3
InChI Key:
OZEKIGMTDMUQLC-UHFFFAOYSA-N
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.145g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
252.096g/mol
Monoisotopic Mass:
252.145g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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