200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1193162-25-2
1193162-25-2 | Benzoic acid, 4-bromo-5-fluoro-2-hydroxy-, methyl ester
CAS No: 1193162-25-2 Catalog No: AG000IL5 MDL No:MFCD23701539
Product Description
Catalog Number:
AG000IL5
Chemical Name:
Benzoic acid, 4-bromo-5-fluoro-2-hydroxy-, methyl ester
CAS Number:
1193162-25-2
Molecular Formula:
C8H6BrFO3
Molecular Weight:
249.0338
MDL Number:
MFCD23701539
IUPAC Name:
methyl 4-bromo-5-fluoro-2-hydroxybenzoate
InChI:
InChI=1S/C8H6BrFO3/c1-13-8(12)4-2-6(10)5(9)3-7(4)11/h2-3,11H,1H3
InChI Key:
WCXWROSPLXHQFI-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(F)c(cc1O)Br
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.948g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.035g/mol
Monoisotopic Mass:
247.948g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.