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Home > Boronic Acids > 1072945-98-2
1072945-98-2 | (2-Chloro-5-methoxypyridin-4-yl)boronic acid
CAS No: 1072945-98-2 Catalog No: AG003BMS MDL No:MFCD09972106
Product Description
Catalog Number:
AG003BMS
Chemical Name:
(2-Chloro-5-methoxypyridin-4-yl)boronic acid
CAS Number:
1072945-98-2
Molecular Formula:
C6H7BClNO3
Molecular Weight:
187.3887
MDL Number:
MFCD09972106
IUPAC Name:
(2-chloro-5-methoxypyridin-4-yl)boronic acid
InChI:
InChI=1S/C6H7BClNO3/c1-12-5-3-9-6(8)2-4(5)7(10)11/h2-3,10-11H,1H3
InChI Key:
RIJYQJUSSTXMRQ-UHFFFAOYSA-N
SMILES:
COc1cnc(cc1B(O)O)Cl
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.021g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
187.386g/mol
Monoisotopic Mass:
187.021g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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