Home Boronic acids 4-(1-Carboxycyclopropyl)-3-fluorophenylboronic acid pinacol ester

4-(1-Carboxycyclopropyl)-3-fluorophenylboronic acid pinacol ester

CAS No.:
2096996-81-3
Catalog Number:
AG01EHNZ
Molecular Formula:
C16H20BFO4
Molecular Weight:
306.1370
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
In Stock USA
United States
$300
- +
250mg
97%
In Stock USA
United States
$563
- +
1g
97%
In Stock USA
United States
$1000
- +
Product Description
Catalog Number:
AG01EHNZ
Chemical Name:
4-(1-Carboxycyclopropyl)-3-fluorophenylboronic acid pinacol ester
CAS Number:
2096996-81-3
Molecular Formula:
C16H20BFO4
Molecular Weight:
306.1370
MDL Number:
MFCD21609690
IUPAC Name:
1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C16H20BFO4/c1-14(2)15(3,4)22-17(21-14)10-5-6-11(12(18)9-10)16(7-8-16)13(19)20/h5-6,9H,7-8H2,1-4H3,(H,19,20)
InChI Key:
WCLUOZCSETWVDM-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CC1)c1ccc(cc1F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
459  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.144g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
306.14g/mol
Monoisotopic Mass:
306.144g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties