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Home > Boronic Acids > 1704121-38-9
1704121-38-9 | (2-FLUORO-4-METHYL-5-((4-METHYLPIPERIDIN-1-YL)SULFONYL)PHENYL)BORONIC ACID
CAS No: 1704121-38-9 Catalog No: AG01DX31 MDL No:
Product Description
Catalog Number:
AG01DX31
Chemical Name:
(2-FLUORO-4-METHYL-5-((4-METHYLPIPERIDIN-1-YL)SULFONYL)PHENYL)BORONIC ACID
CAS Number:
1704121-38-9
IUPAC Name:
[2-fluoro-4-methyl-5-(4-methylpiperidin-1-yl)sulfonylphenyl]boronic acid
InChI:
InChI=1S/C13H19BFNO4S/c1-9-3-5-16(6-4-9)21(19,20)13-8-11(14(17)18)12(15)7-10(13)2/h7-9,17-18H,3-6H2,1-2H3
InChI Key:
YDLMPWJVHKWXPR-UHFFFAOYSA-N
Properties
Complexity:
448
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.111g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
315.166g/mol
Monoisotopic Mass:
315.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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