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Home > Boronic Acids > 282116-97-6
282116-97-6 | 4-(2-ETHOXY-2-OXOETHOXY)BENZENEBORONIC ACID 98
CAS No: 282116-97-6 Catalog No: AG00BEC7 MDL No:MFCD08235079
Product Description
Catalog Number:
AG00BEC7
Chemical Name:
4-(2-ETHOXY-2-OXOETHOXY)BENZENEBORONIC ACID 98
CAS Number:
282116-97-6
Molecular Formula:
C10H13BO5
Molecular Weight:
224.0182
MDL Number:
MFCD08235079
IUPAC Name:
[4-(2-ethoxy-2-oxoethoxy)phenyl]boronic acid
InChI:
InChI=1S/C10H13BO5/c1-2-15-10(12)7-16-9-5-3-8(4-6-9)11(13)14/h3-6,13-14H,2,7H2,1H3
InChI Key:
MECJJOCHJYCOJS-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1ccc(cc1)B(O)O
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.086g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
224.019g/mol
Monoisotopic Mass:
224.086g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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