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397843-72-0
Catalog No.:AA01FPHT
397843-72-0 | Boronic acid, [3-[(dibutylamino)carbonyl]phenyl]- (9CI)
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250mg
95%
2 weeks  
$455.00   $318.00
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1g
95%
2 weeks  
$774.00   $542.00
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5g
95%
2 weeks  
$1,814.00   $1,270.00
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Technical Information
Catalog Number:
AA01FPHT
Chemical Name:
Boronic acid, [3-[(dibutylamino)carbonyl]phenyl]- (9CI)
CAS Number:
397843-72-0
Molecular Formula:
C15H24BNO3
Molecular Weight:
277.1670
IUPAC Name:
[3-(dibutylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C15H24BNO3/c1-3-5-10-17(11-6-4-2)15(18)13-8-7-9-14(12-13)16(19)20/h7-9,12,19-20H,3-6,10-11H2,1-2H3
InChI Key:
UEUNTIZOTIFCJK-UHFFFAOYSA-N
SMILES:
CCCCN(C(=O)c1cccc(c1)B(O)O)CCCC
Properties
Computed Properties
 
Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.184924g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
277.17g/mol
Monoisotopic Mass:
277.184924g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
60.8Ų
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
Boronic acid, [3-[(dibutylamino)carbonyl]phenyl]- 
397843-72-0 
[3-(dibutylcarbamoyl)phenyl]boronic Acid 
SCHEMBL6355135 
AS-69824 
CID10858777 
Literature
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