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Home > Boronic Acids > 874219-16-6
874219-16-6 | (2-(Dimethylcarbamoyl);phenyl);boronic acid
CAS No: 874219-16-6 Catalog No: AG004J9R MDL No:MFCD03425959
Product Description
Catalog Number:
AG004J9R
Chemical Name:
(2-(Dimethylcarbamoyl);phenyl);boronic acid
CAS Number:
874219-16-6
Molecular Formula:
C9H12BNO3
Molecular Weight:
193.0075
MDL Number:
MFCD03425959
IUPAC Name:
[2-(dimethylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C9H12BNO3/c1-11(2)9(12)7-5-3-4-6-8(7)10(13)14/h3-6,13-14H,1-2H3
InChI Key:
NZIOVLXULSCCSG-UHFFFAOYSA-N
SMILES:
CN(C(=O)c1ccccc1B(O)O)C
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.091g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.009g/mol
Monoisotopic Mass:
193.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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