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Home > Boronic Acids > 1310384-33-8
1310384-33-8 | 3-Pyridinecarbonitrile, 5-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1310384-33-8 Catalog No: AG000VDK MDL No:MFCD08063032
Product Description
Catalog Number:
AG000VDK
Chemical Name:
3-Pyridinecarbonitrile, 5-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1310384-33-8
Molecular Formula:
C13H17BN2O2
Molecular Weight:
244.0973
MDL Number:
MFCD08063032
IUPAC Name:
5-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbonitrile
InChI:
InChI=1S/C13H17BN2O2/c1-9-6-10(7-15)8-16-11(9)14-17-12(2,3)13(4,5)18-14/h6,8H,1-5H3
InChI Key:
XNPIYQSLCWJMFY-UHFFFAOYSA-N
SMILES:
N#Cc1cnc(c(c1)C)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.138g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.101g/mol
Monoisotopic Mass:
244.138g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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