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Home > Boronic Acids > 1150114-68-3
1150114-68-3 | Boronic acid, B-(5-chloro-6-ethoxy-3-pyridinyl)-
CAS No: 1150114-68-3 Catalog No: AG000FM9 MDL No:MFCD12025982
Product Description
Catalog Number:
AG000FM9
Chemical Name:
Boronic acid, B-(5-chloro-6-ethoxy-3-pyridinyl)-
CAS Number:
1150114-68-3
Molecular Formula:
C7H9BClNO3
Molecular Weight:
201.4153
MDL Number:
MFCD12025982
IUPAC Name:
(5-chloro-6-ethoxypyridin-3-yl)boronic acid
InChI:
InChI=1S/C7H9BClNO3/c1-2-13-7-6(9)3-5(4-10-7)8(11)12/h3-4,11-12H,2H2,1H3
InChI Key:
PRZRXDHALIHUBT-UHFFFAOYSA-N
SMILES:
CCOc1ncc(cc1Cl)B(O)O
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.036g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.413g/mol
Monoisotopic Mass:
201.036g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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