Home Boronic Acids 1073354-05-8
1073354-05-8,MFCD11504968
Catalog No.:AA0084T0
1073354-05-8 | 2-Methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);nicotinonitrile
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250mg
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  • Technical Information
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Technical Information
Catalog Number:
AA0084T0
Chemical Name:
2-Methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);nicotinonitrile
CAS Number:
1073354-05-8
Molecular Formula:
C13H17BN2O3
Molecular Weight:
260.0967
MDL Number:
MFCD11504968
IUPAC Name:
2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbonitrile
InChI:
InChI=1S/C13H17BN2O3/c1-12(2)13(3,4)19-14(18-12)10-6-9(7-15)11(17-5)16-8-10/h6,8H,1-5H3
InChI Key:
JIDHBYJKXYDCDB-UHFFFAOYSA-N
SMILES:
N#Cc1cc(cnc1OC)B1OC(C(O1)(C)C)(C)C
Properties
Computed Properties
 
Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.133g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.1g/mol
Monoisotopic Mass:
260.133g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1073354-05-8 
2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinonitrile 
MFCD11504968 
RW3586 
AKOS015999250 
ZINC169745239 
FCH2838077 
MB09902 
QC-2615 
RL00323 
RTR-001730 
AK-91697 
3-Cyano-2-methoxypyridine-5-boronic acid, pinacol ester 
AM802896 
OR360090 
PS-13071 
AB0047124 
AX8164503 
TR-001730 
FT-0756232 
ST24028070 
A-4820 
J-509814 
2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbonitrile 
3-Cyano-2-methoxypyridine-5-boronic acid,pinacol ester 
5-CYANO-6-METHOXYPYRIDINE-3-BORONIC ACID PINACOL ESTER 
(5-CYANO-6-METHOXYPYRIDIN-3-YL)BORONIC ACID PINACOL ESTER 
2-Methoxy-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-nicotinonitrile 
2-methoxy-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)nicotinonitrile 
PubChem20153 
SCHEMBL3451096 
CTK8B3670 
DTXSID20674767 
JIDHBYJKXYDCDB-UHFFFAOYSA-N 
ANW-42923 
Literature
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