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1451393-46-6

1451393-46-6 | Boronic acid, B-[2-fluoro-4-(4-morpholinylmethyl)phenyl]-

CAS No: 1451393-46-6 Catalog No: AG01FFYJ MDL No:

Product Description

Catalog Number:
AG01FFYJ
Chemical Name:
Boronic acid, B-[2-fluoro-4-(4-morpholinylmethyl)phenyl]-
CAS Number:
1451393-46-6
Molecular Formula:
C11H15BFNO3
Molecular Weight:
239.0511
IUPAC Name:
[2-fluoro-4-(morpholin-4-ylmethyl)phenyl]boronic acid
InChI:
InChI=1S/C11H15BFNO3/c13-11-7-9(1-2-10(11)12(15)16)8-14-3-5-17-6-4-14/h1-2,7,15-16H,3-6,8H2
InChI Key:
DCGZQOHKVDEKNF-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1F)CN1CCOCC1)O

Properties

Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.113g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
239.053g/mol
Monoisotopic Mass:
239.113g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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