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1309981-31-4

1309981-31-4 | 3-Pyridinecarbonitrile, 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

CAS No: 1309981-31-4 Catalog No: AG000V8Y MDL No:MFCD09743401

Product Description

Catalog Number:
AG000V8Y
Chemical Name:
3-Pyridinecarbonitrile, 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1309981-31-4
Molecular Formula:
C12H15BN2O2
Molecular Weight:
230.0707
MDL Number:
MFCD09743401
IUPAC Name:
2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbonitrile
InChI:
InChI=1S/C12H15BN2O2/c1-11(2)12(3,4)17-13(16-11)10-9(8-14)6-5-7-15-10/h5-7H,1-4H3
InChI Key:
QTLDCKOLCHHZGE-UHFFFAOYSA-N
SMILES:
N#Cc1cccnc1B1OC(C(O1)(C)C)(C)C

Properties

Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.123g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.074g/mol
Monoisotopic Mass:
230.123g/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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