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Home > Boronic Acids > 177490-82-3
177490-82-3 | Boronic acid, B-[4-(acetyloxy)phenyl]-
CAS No: 177490-82-3 Catalog No: AG0025CJ MDL No:MFCD01632203
Product Description
Catalog Number:
AG0025CJ
Chemical Name:
Boronic acid, B-[4-(acetyloxy)phenyl]-
CAS Number:
177490-82-3
Molecular Formula:
C8H9BO4
Molecular Weight:
179.9657
MDL Number:
MFCD01632203
IUPAC Name:
(4-acetyloxyphenyl)boronic acid
InChI:
InChI=1S/C8H9BO4/c1-6(10)13-8-4-2-7(3-5-8)9(11)12/h2-5,11-12H,1H3
InChI Key:
VILXJXDXZGKJLU-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)OC(=O)C)O
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.966g/mol
Monoisotopic Mass:
180.059g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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