sales@angenesci.com
Login | Register
logo
Structures Search
Home Boronic acids (5-Chloro-2H-1,3-benzodioxol-4-yl)boronic acid

(5-Chloro-2H-1,3-benzodioxol-4-yl)boronic acid

CAS No.:
2087452-50-2
Catalog Number:
AG00IM19
Molecular Formula:
C7H6BClO4
Molecular Weight:
200.3841
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$313
- +
5g
95%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG00IM19
Chemical Name:
(5-Chloro-2H-1,3-benzodioxol-4-yl)boronic acid
CAS Number:
2087452-50-2
Molecular Formula:
C7H6BClO4
Molecular Weight:
200.3841
MDL Number:
MFCD31382028
IUPAC Name:
(5-chloro-1,3-benzodioxol-4-yl)boronic acid
InChI:
InChI=1S/C7H6BClO4/c9-4-1-2-5-7(13-3-12-5)6(4)8(10)11/h1-2,10-11H,3H2
InChI Key:
OJUBGVPJUUYQRE-UHFFFAOYSA-N
SMILES:
OB(c1c(Cl)ccc2c1OCO2)O
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.005g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.381g/mol
Monoisotopic Mass:
200.005g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties