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107099-99-0 | (2,5-Dimethoxyphenyl)boronic acid
CAS No: 107099-99-0 Catalog No: AG003FZ4 MDL No:MFCD01318181
Product Description
Catalog Number:
AG003FZ4
Chemical Name:
(2,5-Dimethoxyphenyl)boronic acid
CAS Number:
107099-99-0
Molecular Formula:
C8H11BO4
Molecular Weight:
181.9815
MDL Number:
MFCD01318181
IUPAC Name:
(2,5-dimethoxyphenyl)boronic acid
InChI:
InChI=1S/C8H11BO4/c1-12-6-3-4-8(13-2)7(5-6)9(10)11/h3-5,10-11H,1-2H3
InChI Key:
QOZLFNQLIKOGDR-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)B(O)O)OC
Properties
Complexity:
153
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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