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Home > Boronic Acids > 1072946-24-7
1072946-24-7 | Monolithium 4-methoxypyridine-3-boronate
CAS No: 1072946-24-7 Catalog No: AG003S5N MDL No:MFCD10699631
Product Description
Catalog Number:
AG003S5N
Chemical Name:
Monolithium 4-methoxypyridine-3-boronate
CAS Number:
1072946-24-7
Molecular Formula:
C6H7BLiNO3
Molecular Weight:
158.8767
MDL Number:
MFCD10699631
IUPAC Name:
lithium;hydroxy-(4-methoxypyridin-3-yl)borinate
InChI:
InChI=1S/C6H7BNO3.Li/c1-11-6-2-3-8-4-5(6)7(9)10;/h2-4,9H,1H3;/q-1;+1
InChI Key:
HPEJWXOXWXXSAQ-UHFFFAOYSA-N
SMILES:
COc1ccncc1B(O)[O-].[Li+]
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.876g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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