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Home > Boronic Acids > 1218790-91-0
1218790-91-0 | Boronic acid, B-[3-[(1-naphthalenyloxy)methyl]phenyl]-
CAS No: 1218790-91-0 Catalog No: AG0016A2 MDL No:
Product Description
Catalog Number:
AG0016A2
Chemical Name:
Boronic acid, B-[3-[(1-naphthalenyloxy)methyl]phenyl]-
CAS Number:
1218790-91-0
Molecular Formula:
C17H15BO3
Molecular Weight:
278.1102
IUPAC Name:
[3-(naphthalen-1-yloxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C17H15BO3/c19-18(20)15-8-3-5-13(11-15)12-21-17-10-4-7-14-6-1-2-9-16(14)17/h1-11,19-20H,12H2
InChI Key:
SBVPZHOJJDYHHW-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)COc1cccc2c1cccc2)O
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.111g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
278.114g/mol
Monoisotopic Mass:
278.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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