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Home > Boronic Acids > 223433-45-2
223433-45-2 | 2-(Morpholin-4-ylmethyl)benzeneboronic acid
CAS No: 223433-45-2 Catalog No: AG00BDT6 MDL No:MFCD01319041
Product Description
Catalog Number:
AG00BDT6
Chemical Name:
2-(Morpholin-4-ylmethyl)benzeneboronic acid
CAS Number:
223433-45-2
Molecular Formula:
C11H16BNO3
Molecular Weight:
221.0606
MDL Number:
MFCD01319041
IUPAC Name:
[2-(morpholin-4-ylmethyl)phenyl]boronic acid
InChI:
InChI=1S/C11H16BNO3/c14-12(15)11-4-2-1-3-10(11)9-13-5-7-16-8-6-13/h1-4,14-15H,5-9H2
InChI Key:
DFBBOZSTIQMBLF-UHFFFAOYSA-N
SMILES:
OB(c1ccccc1CN1CCOCC1)O
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.122g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.063g/mol
Monoisotopic Mass:
221.122g/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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