Home Halogens Methyl 4-borono-3-chlorobenzoate

Methyl 4-borono-3-chlorobenzoate

CAS No.:
603122-80-1
Catalog Number:
AG00EB41
Molecular Formula:
C8H8BClO4
Molecular Weight:
214.4107
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$38
- +
5g
98%
In Stock USA
United States
$144
- +
10g
98%
In Stock USA
United States
$238
- +
25g
98%
In Stock USA
United States
$469
- +
Product Description
Catalog Number:
AG00EB41
Chemical Name:
Methyl 4-borono-3-chlorobenzoate
CAS Number:
603122-80-1
Molecular Formula:
C8H8BClO4
Molecular Weight:
214.4107
MDL Number:
MFCD08689530
IUPAC Name:
(2-chloro-4-methoxycarbonylphenyl)boronic acid
InChI:
InChI=1S/C8H8BClO4/c1-14-8(11)5-2-3-6(9(12)13)7(10)4-5/h2-4,12-13H,1H3
InChI Key:
ITEQHBSWRMYSRP-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)Cl)B(O)O
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
214.408g/mol
Monoisotopic Mass:
214.02g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties