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Home Boronic acids 3-Chloro-5-fluoro-4-propoxyphenylboronic acid

3-Chloro-5-fluoro-4-propoxyphenylboronic acid

CAS No.:
2096341-48-7
Catalog Number:
AG01EHHQ
Molecular Formula:
C9H11BClFO3
Molecular Weight:
232.4442
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG01EHHQ
Chemical Name:
3-Chloro-5-fluoro-4-propoxyphenylboronic acid
CAS Number:
2096341-48-7
Molecular Formula:
C9H11BClFO3
Molecular Weight:
232.4442
MDL Number:
MFCD20441801
IUPAC Name:
(3-chloro-5-fluoro-4-propoxyphenyl)boronic acid
InChI:
InChI=1S/C9H11BClFO3/c1-2-3-15-9-7(11)4-6(10(13)14)5-8(9)12/h4-5,13-14H,2-3H2,1H3
InChI Key:
QDMDQPSRPPTLBY-UHFFFAOYSA-N
SMILES:
CCCOc1c(F)cc(cc1Cl)B(O)O
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.047g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
232.442g/mol
Monoisotopic Mass:
232.047g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties