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Home > Boronic Acids > 1333411-99-6
1333411-99-6 | [2-(oxolan-3-ylmethoxy)phenyl]boronic acid
CAS No: 1333411-99-6 Catalog No: AG019YQ8 MDL No:MFCD14691768
Product Description
Catalog Number:
AG019YQ8
Chemical Name:
[2-(oxolan-3-ylmethoxy)phenyl]boronic acid
CAS Number:
1333411-99-6
Molecular Formula:
C11H15BO4
Molecular Weight:
222.0454
MDL Number:
MFCD14691768
IUPAC Name:
[2-(oxolan-3-ylmethoxy)phenyl]boronic acid
InChI:
InChI=1S/C11H15BO4/c13-12(14)10-3-1-2-4-11(10)16-8-9-5-6-15-7-9/h1-4,9,13-14H,5-8H2
InChI Key:
PVWGIVALWGYJIB-UHFFFAOYSA-N
SMILES:
OB(c1ccccc1OCC1COCC1)O
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
222.047g/mol
Monoisotopic Mass:
222.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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