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Home > Boronic Acids > 106832-86-4
106832-86-4 | Boronic acid,(2-propyl-5-pyrimidinyl)-, dimethyl ester (9CI)
CAS No: 106832-86-4 Catalog No: AG007TV5 MDL No:
Product Description
Catalog Number:
AG007TV5
Chemical Name:
Boronic acid,(2-propyl-5-pyrimidinyl)-, dimethyl ester (9CI)
CAS Number:
106832-86-4
Molecular Formula:
C9H15BN2O2
Molecular Weight:
194.0386
IUPAC Name:
dimethoxy-(2-propylpyrimidin-5-yl)borane
InChI:
InChI=1S/C9H15BN2O2/c1-4-5-9-11-6-8(7-12-9)10(13-2)14-3/h6-7H,4-5H2,1-3H3
InChI Key:
ZVKAQHRKGLXCGI-UHFFFAOYSA-N
SMILES:
CCCc1ncc(cn1)B(OC)OC
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.123g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.041g/mol
Monoisotopic Mass:
194.123g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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