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Home > Boronic Acids > 1072951-92-8
1072951-92-8 | (3,5-Diformyl-2-propoxyphenyl);boronic acid
CAS No: 1072951-92-8 Catalog No: AG003BQM MDL No:MFCD09750469
Product Description
Catalog Number:
AG003BQM
Chemical Name:
(3,5-Diformyl-2-propoxyphenyl);boronic acid
CAS Number:
1072951-92-8
Molecular Formula:
C11H13BO5
Molecular Weight:
236.0289
MDL Number:
MFCD09750469
IUPAC Name:
(3,5-diformyl-2-propoxyphenyl)boronic acid
InChI:
InChI=1S/C11H13BO5/c1-2-3-17-11-9(7-14)4-8(6-13)5-10(11)12(15)16/h4-7,15-16H,2-3H2,1H3
InChI Key:
OSVFOHHYFMQYRN-UHFFFAOYSA-N
SMILES:
CCCOc1c(C=O)cc(cc1B(O)O)C=O
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.086g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.03g/mol
Monoisotopic Mass:
236.086g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
83.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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