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Home > Boronic Acids > 654664-63-8
654664-63-8 | Triphenylen-2-ylboronic acid
CAS No: 654664-63-8 Catalog No: AG0039I0 MDL No:MFCD16660186
Product Description
Catalog Number:
AG0039I0
Chemical Name:
Triphenylen-2-ylboronic acid
CAS Number:
654664-63-8
Molecular Formula:
C18H13BO2
Molecular Weight:
272.1056
MDL Number:
MFCD16660186
IUPAC Name:
triphenylen-2-ylboronic acid
InChI:
InChI=1S/C18H13BO2/c20-19(21)12-9-10-17-15-7-2-1-5-13(15)14-6-3-4-8-16(14)18(17)11-12/h1-11,20-21H
InChI Key:
PXFBSZZEOWJJNL-UHFFFAOYSA-N
SMILES:
OB(c1ccc2c(c1)c1ccccc1c1c2cccc1)O
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.101g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
272.11g/mol
Monoisotopic Mass:
272.101g/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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