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Home > Boronic Acids > 2096339-81-8
2096339-81-8 | 3-(Pentyloxy)-5-(trifluoromethoxy)phenylboronic acid
CAS No: 2096339-81-8 Catalog No: AG01EHCR MDL No:MFCD18434421
Product Description
Catalog Number:
AG01EHCR
Chemical Name:
3-(Pentyloxy)-5-(trifluoromethoxy)phenylboronic acid
CAS Number:
2096339-81-8
MDL Number:
MFCD18434421
IUPAC Name:
[3-pentoxy-5-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C12H16BF3O4/c1-2-3-4-5-19-10-6-9(13(17)18)7-11(8-10)20-12(14,15)16/h6-8,17-18H,2-5H2,1H3
InChI Key:
KPXIDLPMGPLNPS-UHFFFAOYSA-N
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.109g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
292.061g/mol
Monoisotopic Mass:
292.109g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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