200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 958451-78-0
958451-78-0 | 2-DIFLUOROMETHOXY-3-METHYL-BENZENEBORONIC ACID
CAS No: 958451-78-0 Catalog No: AG005X0G MDL No:
Product Description
Catalog Number:
AG005X0G
Chemical Name:
2-DIFLUOROMETHOXY-3-METHYL-BENZENEBORONIC ACID
CAS Number:
958451-78-0
Molecular Formula:
C8H9BF2O3
Molecular Weight:
201.9631
IUPAC Name:
[2-(difluoromethoxy)-3-methylphenyl]boronic acid
InChI:
InChI=1S/C8H9BF2O3/c1-5-3-2-4-6(9(12)13)7(5)14-8(10)11/h2-4,8,12-13H,1H3
InChI Key:
HCNMYMKJTFLPOQ-UHFFFAOYSA-N
SMILES:
FC(Oc1c(C)cccc1B(O)O)F
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.061g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.964g/mol
Monoisotopic Mass:
202.061g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.