Home Boronic acids 3-Chlorophenylboronic acid

3-Chlorophenylboronic acid

CAS No.:
63503-60-6
Catalog Number:
AG0033O8
Molecular Formula:
C6H6BClO2
Molecular Weight:
156.3746
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
95%
In Stock USA
United States
$35
- +
100g
98%
In Stock USA
United States
$119
- +
500g
98%
In Stock USA
United States
$575
- +
Product Description
Catalog Number:
AG0033O8
Chemical Name:
3-Chlorophenylboronic acid
CAS Number:
63503-60-6
Molecular Formula:
C6H6BClO2
Molecular Weight:
156.3746
MDL Number:
MFCD00161354
IUPAC Name:
(3-chlorophenyl)boronic acid
InChI:
InChI=1S/C6H6BClO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4,9-10H
InChI Key:
SDEAGACSNFSZCU-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)B(O)O
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.015g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
156.372g/mol
Monoisotopic Mass:
156.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
2-(4-Chloro-phen-yl)naphtho-[1,8-de][1,3,2]diaza-borinane. Acta crystallographica. Section E, Structure reports online 20110801
Properties