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Home > Boronic Acids > 1218790-95-4
1218790-95-4 | Boronic acid, B-[2-(2-methylpropoxy)-3-pyridinyl]-
CAS No: 1218790-95-4 Catalog No: AG00169Y MDL No:MFCD07374888
Product Description
Catalog Number:
AG00169Y
Chemical Name:
Boronic acid, B-[2-(2-methylpropoxy)-3-pyridinyl]-
CAS Number:
1218790-95-4
Molecular Formula:
C9H14BNO3
Molecular Weight:
195.0234
MDL Number:
MFCD07374888
IUPAC Name:
[2-(2-methylpropoxy)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C9H14BNO3/c1-7(2)6-14-9-8(10(12)13)4-3-5-11-9/h3-5,7,12-13H,6H2,1-2H3
InChI Key:
VMPOWUYMVMJUSI-UHFFFAOYSA-N
SMILES:
CC(COc1ncccc1B(O)O)C
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.107g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.025g/mol
Monoisotopic Mass:
195.107g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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