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Home > Boronic Acids > 850593-04-3
850593-04-3 | (4-((2-Hydroxyethyl)carbamoyl)phenyl)boronic acid
CAS No: 850593-04-3 Catalog No: AG0036FR MDL No:MFCD06659848
Product Description
Catalog Number:
AG0036FR
Chemical Name:
(4-((2-Hydroxyethyl)carbamoyl)phenyl)boronic acid
CAS Number:
850593-04-3
Molecular Formula:
C9H12BNO4
Molecular Weight:
209.0069
MDL Number:
MFCD06659848
IUPAC Name:
[4-(2-hydroxyethylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C9H12BNO4/c12-6-5-11-9(13)7-1-3-8(4-2-7)10(14)15/h1-4,12,14-15H,5-6H2,(H,11,13)
InChI Key:
UEHHULJBSYEFDG-UHFFFAOYSA-N
SMILES:
OCCNC(=O)c1ccc(cc1)B(O)O
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.086g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
209.008g/mol
Monoisotopic Mass:
209.086g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
89.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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