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Home > Boronic Acids > 1072952-46-5
1072952-46-5 | (Tetrahydro-2H-pyran-4-yl)boronic acid
CAS No: 1072952-46-5 Catalog No: AG0084WA MDL No:MFCD07371555
Product Description
Catalog Number:
AG0084WA
Chemical Name:
(Tetrahydro-2H-pyran-4-yl)boronic acid
CAS Number:
1072952-46-5
Molecular Formula:
C5H11BO3
Molecular Weight:
129.9500
MDL Number:
MFCD07371555
IUPAC Name:
oxan-4-ylboronic acid
InChI:
InChI=1S/C5H11BO3/c7-6(8)5-1-3-9-4-2-5/h5,7-8H,1-4H2
InChI Key:
PJAHYWURJMYDPM-UHFFFAOYSA-N
SMILES:
OB(C1CCOCC1)O
Properties
Complexity:
80.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.08g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
129.95g/mol
Monoisotopic Mass:
130.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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