Home Boronic acids 3-Chloro-4-methylphenylboronic acid

3-Chloro-4-methylphenylboronic acid

CAS No.:
175883-63-3
Catalog Number:
AG00219B
Molecular Formula:
C7H8BClO2
Molecular Weight:
170.4012
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$50
- +
25g
98%
In Stock USA
United States
$207
- +
100g
98%
In Stock USA
United States
$619
- +
Product Description
Catalog Number:
AG00219B
Chemical Name:
3-Chloro-4-methylphenylboronic acid
CAS Number:
175883-63-3
Molecular Formula:
C7H8BClO2
Molecular Weight:
170.4012
MDL Number:
MFCD04039010
IUPAC Name:
(3-chloro-4-methylphenyl)boronic acid
InChI:
InChI=1S/C7H8BClO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4,10-11H,1H3
InChI Key:
YTJUYWRCAZWVSX-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)Cl)C)O
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.031g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
170.399g/mol
Monoisotopic Mass:
170.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties