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Home > Boronic Acids > 181135-36-4

181135-36-4

181135-36-4 | Boronic acid, (8-phenyl-1-naphthalenyl)- (9CI)

CAS No: 181135-36-4 Catalog No: AG0022PX MDL No:

Product Description

Catalog Number:
AG0022PX
Chemical Name:
Boronic acid, (8-phenyl-1-naphthalenyl)- (9CI)
CAS Number:
181135-36-4
Molecular Formula:
C16H13BO2
Molecular Weight:
248.0842
IUPAC Name:
(8-phenylnaphthalen-1-yl)boronic acid
InChI:
InChI=1S/C16H13BO2/c18-17(19)15-11-5-9-13-8-4-10-14(16(13)15)12-6-2-1-3-7-12/h1-11,18-19H
InChI Key:
QBNRXBKYDVJTHS-UHFFFAOYSA-N
SMILES:
OB(c1cccc2c1c(ccc2)c1ccccc1)O

Properties

Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.101g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
248.088g/mol
Monoisotopic Mass:
248.101g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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