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Home > Boronic Acids > 915201-13-7
915201-13-7 | 3-ETHOXY-4-METHOXYPHENYLBORONIC ACID
CAS No: 915201-13-7 Catalog No: AG00H1UV MDL No:MFCD09972114
Product Description
Catalog Number:
AG00H1UV
Chemical Name:
3-ETHOXY-4-METHOXYPHENYLBORONIC ACID
CAS Number:
915201-13-7
Molecular Formula:
C9H13BO4
Molecular Weight:
196.0081
MDL Number:
MFCD09972114
IUPAC Name:
(3-ethoxy-4-methoxyphenyl)boronic acid
InChI:
InChI=1S/C9H13BO4/c1-3-14-9-6-7(10(11)12)4-5-8(9)13-2/h4-6,11-12H,3H2,1-2H3
InChI Key:
QQECMULEKNGSEB-UHFFFAOYSA-N
SMILES:
CCOc1cc(ccc1OC)B(O)O
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.091g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.009g/mol
Monoisotopic Mass:
196.091g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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