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Home > Boronic Acids > 1002127-60-7
1002127-60-7 | Boronic acid, B-(3,6-dihydro-2H-pyran-4-yl)-
CAS No: 1002127-60-7 Catalog No: AG00019B MDL No:MFCD02179502
Product Description
Catalog Number:
AG00019B
Chemical Name:
Boronic acid, B-(3,6-dihydro-2H-pyran-4-yl)-
CAS Number:
1002127-60-7
Molecular Formula:
C5H9BO3
Molecular Weight:
127.9342
MDL Number:
MFCD02179502
IUPAC Name:
3,6-dihydro-2H-pyran-4-ylboronic acid
InChI:
InChI=1S/C5H9BO3/c7-6(8)5-1-3-9-4-2-5/h1,7-8H,2-4H2
InChI Key:
YVWATSXVUOJOIG-UHFFFAOYSA-N
SMILES:
OB(C1=CCOCC1)O
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.064g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
127.934g/mol
Monoisotopic Mass:
128.064g/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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