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Home > Boronic Acids > 192182-54-0
192182-54-0 | Boronic acid, B-(3,5-dimethoxyphenyl)-
CAS No: 192182-54-0 Catalog No: AG002FP8 MDL No:MFCD03095127
Product Description
Catalog Number:
AG002FP8
Chemical Name:
Boronic acid, B-(3,5-dimethoxyphenyl)-
CAS Number:
192182-54-0
Molecular Formula:
C8H11BO4
Molecular Weight:
181.9815
MDL Number:
MFCD03095127
IUPAC Name:
(3,5-dimethoxyphenyl)boronic acid
InChI:
InChI=1S/C8H11BO4/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5,10-11H,1-2H3
InChI Key:
XUIURRYWQBBCCK-UHFFFAOYSA-N
SMILES:
COc1cc(OC)cc(c1)B(O)O
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.075g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
181.982g/mol
Monoisotopic Mass:
182.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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