Home Boronic acids 6-Bromo-3-chloro-2-fluorophenylboronic acid

6-Bromo-3-chloro-2-fluorophenylboronic acid

CAS No.:
1451392-87-2
Catalog Number:
AG00ASK6
Molecular Formula:
C6H4BBrClFO2
Molecular Weight:
253.2612
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Product Description
Catalog Number:
AG00ASK6
Chemical Name:
6-Bromo-3-chloro-2-fluorophenylboronic acid
CAS Number:
1451392-87-2
Molecular Formula:
C6H4BBrClFO2
Molecular Weight:
253.2612
MDL Number:
MFCD11111906
IUPAC Name:
(6-bromo-3-chloro-2-fluorophenyl)boronic acid
InChI:
InChI=1S/C6H4BBrClFO2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2,11-12H
InChI Key:
RQWDCSBDDYTXMA-UHFFFAOYSA-N
SMILES:
OB(c1c(Br)ccc(c1F)Cl)O
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.916g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.258g/mol
Monoisotopic Mass:
251.916g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties