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Home > Boronic Acids > 2096339-85-2
2096339-85-2 | 4-Cyano-3-isopropoxyphenylboronic acid
CAS No: 2096339-85-2 Catalog No: AG01EHEX MDL No:MFCD19684098
Product Description
Catalog Number:
AG01EHEX
Chemical Name:
4-Cyano-3-isopropoxyphenylboronic acid
CAS Number:
2096339-85-2
MDL Number:
MFCD19684098
IUPAC Name:
(4-cyano-3-propan-2-yloxyphenyl)boronic acid
InChI:
InChI=1S/C10H12BNO3/c1-7(2)15-10-5-9(11(13)14)4-3-8(10)6-12/h3-5,7,13-14H,1-2H3
InChI Key:
XRTVNVUITJLVSU-UHFFFAOYSA-N
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.091g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
205.02g/mol
Monoisotopic Mass:
205.091g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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