Home Boronic Acids 845885-86-1
845885-86-1,MFCD03425979
Catalog No.:AA003I2R
845885-86-1 | Pyridine-3-boronic acid, neopentyl glycol ester
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1g
95%
in stock  
$22.00   $15.00
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5g
95%
in stock  
$79.00   $55.00
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10g
95%
in stock  
$136.00   $95.00
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25g
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$258.00   $180.00
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100g
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$953.00   $667.00
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  • Technical Information
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Technical Information
Catalog Number:
AA003I2R
Chemical Name:
Pyridine-3-boronic acid, neopentyl glycol ester
CAS Number:
845885-86-1
Molecular Formula:
C10H14BNO2
Molecular Weight:
191.0347
MDL Number:
MFCD03425979
IUPAC Name:
3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)pyridine
InChI:
InChI=1S/C10H14BNO2/c1-10(2)7-13-11(14-8-10)9-4-3-5-12-6-9/h3-6H,7-8H2,1-2H3
InChI Key:
QMEKTOQBDDVVBE-UHFFFAOYSA-N
SMILES:
CC1(C)COB(OC1)c1cccnc1
Properties
Computed Properties
 
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.112g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.037g/mol
Monoisotopic Mass:
191.112g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)pyridine 
845885-86-1 
QMEKTOQBDDVVBE-UHFFFAOYSA-N 
BM221 
ANW-41721 
MFCD03425979 
SBB091231 
AKOS004116293 
ZINC169743815 
AB14739 
RTR-026153 
VP10539 
3-Pyridineboronic acid neopentylglycol ester 
Pyridine-3-boronic acid neopentyl ester 
DB-021681 
TR-026153 
FT-0084936 
FT-0644901 
ST24032567 
B-5073 
3-Pyridineboronic acid neopentylglycol ester, 97% 
5,5-dimethyl-2-(3-pyridyl)-1,3,2-dioxaborane 
5,5-Dimethyl-2-(3-pyridyl)-1,3,2-dioxaborinane 
Pyridine-3-boronic acid neopentylglycol ester 
I04-4424 
2-(3-Pyridinyl)-5,5-dimethyl-1,3,2-dioxaborinane 
5,5-Dimethyl-2-(pyridin-3-yl)-1,3,2-dioxaborinane 
CID2794717 
pyridine-3-boronic acid, neopentyl ester 
2- -5,5-DIMETHYL-1,3,2-DIOXABORONANE 
2-(4-PYRIDIL)-5,5-DIMETHYL-1,3,2-DIOXABORONANE 
Pyridine-3-boronic acid, neopentyl glycol ester 
AC1MDRQK 
SCHEMBL4078174 
CTK6B2282 
DTXSID20383347 
Literature
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