200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 958451-72-4
958451-72-4 | [4-(difluoromethoxy)-3-methylphenyl]boronic acid
CAS No: 958451-72-4 Catalog No: AG00IJH0 MDL No:MFCD11036079
Product Description
Catalog Number:
AG00IJH0
Chemical Name:
[4-(difluoromethoxy)-3-methylphenyl]boronic acid
CAS Number:
958451-72-4
Molecular Formula:
C8H9BF2O3
Molecular Weight:
201.9631
MDL Number:
MFCD11036079
IUPAC Name:
[4-(difluoromethoxy)-3-methylphenyl]boronic acid
InChI:
InChI=1S/C8H9BF2O3/c1-5-4-6(9(12)13)2-3-7(5)14-8(10)11/h2-4,8,12-13H,1H3
InChI Key:
HNSXGLPRKOFDNV-UHFFFAOYSA-N
SMILES:
FC(Oc1ccc(cc1C)B(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.