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Home Boronic Acids 1025708-31-9
1025708-31-9,MFCD08669562
Catalog No.:AA0007OM
1025708-31-9 | 2-Cyanopyrimidine-5-boronic acid pinacol ester
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$86.00   $60.00
- +
5g
95%
in stock  
$316.00   $221.00
- +
25g
95%
in stock  
$1,213.00   $849.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA0007OM
Chemical Name:
2-Cyanopyrimidine-5-boronic acid pinacol ester
CAS Number:
1025708-31-9
Molecular Formula:
C11H14BN3O2
Molecular Weight:
231.0588
MDL Number:
MFCD08669562
IUPAC Name:
5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine-2-carbonitrile
InChI:
InChI=1S/C11H14BN3O2/c1-10(2)11(3,4)17-12(16-10)8-6-14-9(5-13)15-7-8/h6-7H,1-4H3
InChI Key:
KJQVHJSIJTVCMN-UHFFFAOYSA-N
SMILES:
N#Cc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Properties
Computed Properties
 
Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.118g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.062g/mol
Monoisotopic Mass:
231.118g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1025708-31-9 
2-CYANOPYRIMIDINE-5-BORONIC ACID PINACOL ESTER 
AKOS022172765 
ZINC169747365 
AB45911 
FCH2820258 
RTR-000631 
NCGC00185028-01 
AK-55940 
CS-13075 
SY008202 
AX8208176 
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine-2-carbonitrile 
ST2406004 
TR-000631 
4CH-004612 
CS-0046254 
FT-0660786 
MFCD08669562 (95%) 
A-4198 
J-000732 
(2-CYANOPYRIMIDIN-5-YL)BORONIC ACID PINACOL ESTER 
2-Cyanopyrimidine-5-boronic acid pinacol ester, AldrichCPR 
SCHEMBL253746 
2-Pyrimidinecarbonitrile, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- 
5-(4,4,5,5-tetramethyl-1,3,2-dioxaboro-lan-2-yl)pyrimidine-2-carbonitrile 
146924-92-7 
CTK8B3688 
DTXSID90586000 
KJQVHJSIJTVCMN-UHFFFAOYSA-N 
KS-000019ER 
ANW-42945 
MFCD08669562 
Literature
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