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Home > Boronic Acids > 91062-38-3
91062-38-3 | 4-(Propoxycarbonyl);phenylboronic acid
CAS No: 91062-38-3 Catalog No: AG006F0H MDL No:MFCD06659852
Product Description
Catalog Number:
AG006F0H
Chemical Name:
4-(Propoxycarbonyl);phenylboronic acid
CAS Number:
91062-38-3
Molecular Formula:
C10H13BO4
Molecular Weight:
208.0188
MDL Number:
MFCD06659852
IUPAC Name:
(4-propoxycarbonylphenyl)boronic acid
InChI:
InChI=1S/C10H13BO4/c1-2-7-15-10(12)8-3-5-9(6-4-8)11(13)14/h3-6,13-14H,2,7H2,1H3
InChI Key:
XJEONFAJOXSZDX-UHFFFAOYSA-N
SMILES:
CCCOC(=O)c1ccc(cc1)B(O)O
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.091g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
208.02g/mol
Monoisotopic Mass:
208.091g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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