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Home > Boronic Acids > 1704068-77-8
1704068-77-8 | (3-(4-ethylpiperazin-1-yl)-5-(trifluoroMethyl)phenyl)boronic acid
CAS No: 1704068-77-8 Catalog No: AG00AR8W MDL No:MFCD28384242
Product Description
Catalog Number:
AG00AR8W
Chemical Name:
(3-(4-ethylpiperazin-1-yl)-5-(trifluoroMethyl)phenyl)boronic acid
CAS Number:
1704068-77-8
MDL Number:
MFCD28384242
IUPAC Name:
[3-(4-ethylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C13H18BF3N2O2/c1-2-18-3-5-19(6-4-18)12-8-10(13(15,16)17)7-11(9-12)14(20)21/h7-9,20-21H,2-6H2,1H3
InChI Key:
KLTZCTRDFVAVEN-UHFFFAOYSA-N
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.141g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
302.104g/mol
Monoisotopic Mass:
302.141g/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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