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Home > Boronic Acids > 868826-84-0
868826-84-0 | 3-((Diethylcarbamoyl)oxy)pyridine-4-boronic acid
CAS No: 868826-84-0 Catalog No: AG00IE8W MDL No:MFCD12964599
Product Description
Catalog Number:
AG00IE8W
Chemical Name:
3-((Diethylcarbamoyl)oxy)pyridine-4-boronic acid
CAS Number:
868826-84-0
Molecular Formula:
C10H15BN2O4
Molecular Weight:
238.0481
MDL Number:
MFCD12964599
IUPAC Name:
[3-(diethylcarbamoyloxy)pyridin-4-yl]boronic acid
InChI:
InChI=1S/C10H15BN2O4/c1-3-13(4-2)10(14)17-9-7-12-6-5-8(9)11(15)16/h5-7,15-16H,3-4H2,1-2H3
InChI Key:
PPQBRXMTXQEANZ-UHFFFAOYSA-N
SMILES:
CCN(C(=O)Oc1cnccc1B(O)O)CC
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.112g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
238.05g/mol
Monoisotopic Mass:
238.112g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
82.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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