200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1315476-07-3
1315476-07-3 | Benzoic acid, 3-borono-2-fluoro-, 1-methyl ester
CAS No: 1315476-07-3 Catalog No: AG000ZEI MDL No:MFCD07374985
Product Description
Catalog Number:
AG000ZEI
Chemical Name:
Benzoic acid, 3-borono-2-fluoro-, 1-methyl ester
CAS Number:
1315476-07-3
Molecular Formula:
C8H8BFO4
Molecular Weight:
197.9561
MDL Number:
MFCD07374985
IUPAC Name:
(2-fluoro-3-methoxycarbonylphenyl)boronic acid
InChI:
InChI=1S/C8H8BFO4/c1-14-8(11)5-3-2-4-6(7(5)10)9(12)13/h2-4,12-13H,1H3
InChI Key:
ZWNQFICBQZRXEB-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1F)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:
198.05g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
197.956g/mol
Monoisotopic Mass:
198.05g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.