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Home > Boronic Acids > 944279-32-7
944279-32-7 | 3-Fluoro-4-(3-morpholinopropoxy)phenylboronic acid
CAS No: 944279-32-7 Catalog No: AG00IMNW MDL No:MFCD22418293
Product Description
Catalog Number:
AG00IMNW
Chemical Name:
3-Fluoro-4-(3-morpholinopropoxy)phenylboronic acid
CAS Number:
944279-32-7
Molecular Formula:
C13H19BFNO4
Molecular Weight:
283.1037
MDL Number:
MFCD22418293
IUPAC Name:
[3-fluoro-4-(3-morpholin-4-ylpropoxy)phenyl]boronic acid
InChI:
InChI=1S/C13H19BFNO4/c15-12-10-11(14(17)18)2-3-13(12)20-7-1-4-16-5-8-19-9-6-16/h2-3,10,17-18H,1,4-9H2
InChI Key:
KJBZMTQVEIRBFX-UHFFFAOYSA-N
SMILES:
Fc1cc(ccc1OCCCN1CCOCC1)B(O)O
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.139g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
283.106g/mol
Monoisotopic Mass:
283.139g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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