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Home > Boronic Acids > 68572-87-2
68572-87-2 | 9-Phenanthreneboronic acid
CAS No: 68572-87-2 Catalog No: AG0034FB MDL No:MFCD00143524
Product Description
Catalog Number:
AG0034FB
Chemical Name:
9-Phenanthreneboronic acid
CAS Number:
68572-87-2
Molecular Formula:
C14H11BO2
Molecular Weight:
222.0469
MDL Number:
MFCD00143524
IUPAC Name:
phenanthren-9-ylboronic acid
InChI:
InChI=1S/C14H11BO2/c16-15(17)14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9,16-17H
InChI Key:
JCDAUYWOHOLVMH-UHFFFAOYSA-N
SMILES:
OB(c1cc2ccccc2c2c1cccc2)O
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
222.05g/mol
Monoisotopic Mass:
222.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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