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Home > Boronic Acids > 397843-67-3
397843-67-3 | (4-(Isopropylcarbamoyl);phenyl);boronic acid
CAS No: 397843-67-3 Catalog No: AG0077CZ MDL No:MFCD04039353
Product Description
Catalog Number:
AG0077CZ
Chemical Name:
(4-(Isopropylcarbamoyl);phenyl);boronic acid
CAS Number:
397843-67-3
Molecular Formula:
C10H14BNO3
Molecular Weight:
207.0341
MDL Number:
MFCD04039353
IUPAC Name:
[4-(propan-2-ylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C10H14BNO3/c1-7(2)12-10(13)8-3-5-9(6-4-8)11(14)15/h3-7,14-15H,1-2H3,(H,12,13)
InChI Key:
GBCSEYKTZAKRMT-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)C(=O)NC(C)C)O
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.107g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
207.036g/mol
Monoisotopic Mass:
207.107g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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