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Home > Quinoline > 873101-82-7
873101-82-7 | Borinic acid, ethenyl-3-pyridinyl-, 8-quinolinyl ester
CAS No: 873101-82-7 Catalog No: AG004LHU MDL No:
Product Description
Catalog Number:
AG004LHU
Chemical Name:
Borinic acid, ethenyl-3-pyridinyl-, 8-quinolinyl ester
CAS Number:
873101-82-7
Molecular Formula:
C16H13BN2O
Molecular Weight:
260.0982
IUPAC Name:
ethenyl-pyridin-3-yl-quinolin-8-yloxyborane
InChI:
InChI=1S/C16H13BN2O/c1-2-17(14-8-5-10-18-12-14)20-15-9-3-6-13-7-4-11-19-16(13)15/h2-12H,1H2
InChI Key:
OJRWODKWIZUETD-UHFFFAOYSA-N
SMILES:
C=CB(c1cccnc1)Oc1cccc2c1nccc2
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.112g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.103g/mol
Monoisotopic Mass:
260.112g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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