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Home > Boronic Acids > 351422-73-6
351422-73-6 | (3-Carbamoylphenyl)boronic acid
CAS No: 351422-73-6 Catalog No: AG007FLB MDL No:MFCD03411948
Product Description
Catalog Number:
AG007FLB
Chemical Name:
(3-Carbamoylphenyl)boronic acid
CAS Number:
351422-73-6
Molecular Formula:
C7H8BNO3
Molecular Weight:
164.9543
MDL Number:
MFCD03411948
IUPAC Name:
(3-carbamoylphenyl)boronic acid
InChI:
InChI=1S/C7H8BNO3/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4,11-12H,(H2,9,10)
InChI Key:
WDGWHKRJEBENCE-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)C(=O)N)O
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.06g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
164.955g/mol
Monoisotopic Mass:
165.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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