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Home > Boronic Acids > 1596367-25-7
1596367-25-7 | Pyridine, 2-propyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1596367-25-7 Catalog No: AG001R91 MDL No:MFCD12032365
Product Description
Catalog Number:
AG001R91
Chemical Name:
Pyridine, 2-propyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1596367-25-7
Molecular Formula:
C14H22BNO2
Molecular Weight:
247.1410
MDL Number:
MFCD12032365
IUPAC Name:
2-propyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C14H22BNO2/c1-6-7-12-10-11(8-9-16-12)15-17-13(2,3)14(4,5)18-15/h8-10H,6-7H2,1-5H3
InChI Key:
XIDMCPYEYYYAQJ-UHFFFAOYSA-N
SMILES:
CCCc1nccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.174g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.145g/mol
Monoisotopic Mass:
247.174g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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