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Home > Boronic Acids > 1131735-94-8
1131735-94-8 | (4-(Diisopropylcarbamoyl);-2-ethoxypyridin-3-yl);boronic acid
CAS No: 1131735-94-8 Catalog No: AG007APU MDL No:MFCD18382897
Product Description
Catalog Number:
AG007APU
Chemical Name:
(4-(Diisopropylcarbamoyl);-2-ethoxypyridin-3-yl);boronic acid
CAS Number:
1131735-94-8
Molecular Formula:
C14H23BN2O4
Molecular Weight:
294.1544
MDL Number:
MFCD18382897
IUPAC Name:
[4-[di(propan-2-yl)carbamoyl]-2-ethoxypyridin-3-yl]boronic acid
InChI:
InChI=1S/C14H23BN2O4/c1-6-21-13-12(15(19)20)11(7-8-16-13)14(18)17(9(2)3)10(4)5/h7-10,19-20H,6H2,1-5H3
InChI Key:
ANZPBKCEGYLFFT-UHFFFAOYSA-N
SMILES:
CCOc1nccc(c1B(O)O)C(=O)N(C(C)C)C(C)C
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.175g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
294.158g/mol
Monoisotopic Mass:
294.175g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
82.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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