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Home > Boronic Acids > 135791-72-9
135791-72-9 | Boronic acid, [2-(2-naphthalenyl)ethyl]-
CAS No: 135791-72-9 Catalog No: AG007N6F MDL No:
Product Description
Catalog Number:
AG007N6F
Chemical Name:
Boronic acid, [2-(2-naphthalenyl)ethyl]-
CAS Number:
135791-72-9
Molecular Formula:
C12H13BO2
Molecular Weight:
200.0414
IUPAC Name:
2-naphthalen-2-ylethylboronic acid
InChI:
InChI=1S/C12H13BO2/c14-13(15)8-7-10-5-6-11-3-1-2-4-12(11)9-10/h1-6,9,14-15H,7-8H2
InChI Key:
JJMSWOAYYIOHPY-UHFFFAOYSA-N
SMILES:
OB(CCc1ccc2c(c1)cccc2)O
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.101g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.044g/mol
Monoisotopic Mass:
200.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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