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Home > Boronic Acids > 915200-81-6
915200-81-6 | 2,4-Dichloro-5-ethoxyphenylboronic acid
CAS No: 915200-81-6 Catalog No: AG00GTE8 MDL No:MFCD17015750
Product Description
Catalog Number:
AG00GTE8
Chemical Name:
2,4-Dichloro-5-ethoxyphenylboronic acid
CAS Number:
915200-81-6
Molecular Formula:
C8H9BCl2O3
Molecular Weight:
234.8723
MDL Number:
MFCD17015750
IUPAC Name:
(2,4-dichloro-5-ethoxyphenyl)boronic acid
InChI:
InChI=1S/C8H9BCl2O3/c1-2-14-8-3-5(9(12)13)6(10)4-7(8)11/h3-4,12-13H,2H2,1H3
InChI Key:
VVHOCDCNPFIXLE-UHFFFAOYSA-N
SMILES:
CCOc1cc(B(O)O)c(cc1Cl)Cl
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.002g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.867g/mol
Monoisotopic Mass:
234.002g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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