Home Boronic Acids 1256359-15-5
1256359-15-5,MFCD16660302
Catalog No.:AA000O3B
1256359-15-5 | 1H-Pyrazole, 1-(1,1-dimethylethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
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250mg
97%
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$76.00
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1g
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$193.00
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Technical Information
Catalog Number:
AA000O3B
Chemical Name:
1H-Pyrazole, 1-(1,1-dimethylethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1256359-15-5
Molecular Formula:
C13H23BN2O2
Molecular Weight:
250.1449
MDL Number:
MFCD16660302
IUPAC Name:
1-tert-butyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
InChI:
InChI=1S/C13H23BN2O2/c1-11(2,3)16-9-10(8-15-16)14-17-12(4,5)13(6,7)18-14/h8-9H,1-7H3
InChI Key:
MXAMURVMMKANFD-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cnn(c1)C(C)(C)C
Properties
Computed Properties
 
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.185g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.149g/mol
Monoisotopic Mass:
250.185g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1256359-15-5 
1-(tert-Butyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole 
ANW-53255 
MFCD16660302 
AKOS015841360 
ZINC169746571 
CS-W005224 
SB15551 
AK-93870 
DS-17889 
AB0074511 
TX-011594 
1-tert-Butyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole 
FT-0746228 
ST24021195 
B-2776 
1-tert-butylpyrazole-4-boronic acid pinacol ester 
(1-(TERT-BUTYL)-1H-PYRAZOL-4-YL)BORONIC ACID PINACOL ESTER 
1-tert-butyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole 
1-(1,1-Dimethylethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole 
1H-Pyrazole, 1-(1,1-dimethylethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- 
2-Methyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)propanenitrile 
1-t-Butylpyrazole-4-boronic acid, pinacol ester 
1-tert-butyl-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole 
MXAMURVMMKANFD-UHFFFAOYSA-N 
SCHEMBL2588010 
CTK8B6304 
DTXSID50682214 
KS-00000Q1F 
Literature
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