Home Boronic Acids 1160561-31-8
1160561-31-8,MFCD07778020
Catalog No.:AA000BF7
1160561-31-8 | 3-Chloro-5-(trifluoromethyl)phenylboronic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$8.00   $6.00
- +
1g
97%
in stock  
$18.00   $12.00
- +
5g
97%
in stock  
$50.00   $35.00
- +
10g
97%
in stock  
$95.00   $67.00
- +
25g
97%
in stock  
$183.00   $128.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA000BF7
Chemical Name:
3-Chloro-5-(trifluoromethyl)phenylboronic acid
CAS Number:
1160561-31-8
Molecular Formula:
C7H5BClF3O2
Molecular Weight:
224.3726
MDL Number:
MFCD07778020
IUPAC Name:
[3-chloro-5-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H5BClF3O2/c9-6-2-4(7(10,11)12)1-5(3-6)8(13)14/h1-3,13-14H
InChI Key:
VRZOZHNVFRLIPB-UHFFFAOYSA-N
SMILES:
Clc1cc(cc(c1)C(F)(F)F)B(O)O
Properties
Computed Properties
 
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.002g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
224.37g/mol
Monoisotopic Mass:
224.002g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1160561-31-8 
3-Chloro-5-(trifluoromethyl)phenylboronic acid 
DTXSID60590376 
3-Borono-5-chlorobenzotrifluoride 
VRZOZHNVFRLIPB-UHFFFAOYSA-N 
BM595 
KS-000019DJ 
ANW-16933 
MFCD07778020 
SBB096692 
AKOS015848924 
ZINC169743625 
(3-Chloro-5-(trifluoromethyl)phenyl)boronic acid 
AK-43171 
AM804393 
DS-14114 
SY025281 
DB-010567 
TR-034147 
4CH-024365 
FT-0732385 
ST24034359 
X2119 
3-Chloro-5-trifluoromethylphenylboronic acid 
Z7753 
MFCD07778020 (95%) 
A-5213 
I04-2567 
3-Chloro-5-trifluoromethylphenylboronic acid, AldrichCPR 
Boronic acid, B-[3-chloro-5-(trifluoromethyl)phenyl]- 
C7H5BClF3O2 
ACN-032631 
3-Chloro-5-(trifluoromethyl)phenylboronic acid, 97% - 1G 1g 
847756-88-1 
3-Chloro-5-(trifluoromethyl)benzeneboronic acid 
[3-chloro-5-(trifluoromethyl)phenyl]boronic acid 
3-CHLORO-5-(TRIFLUOROMETHYL)PHENYLBORONICACID 
ACMC-2099rr 
SCHEMBL1199146 
CTK4A9619 
Literature
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