200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1807208-91-8
1807208-91-8 | Benzoic acid, 3-bromo-5-fluoro-4-nitro-, ethyl ester
CAS No: 1807208-91-8 Catalog No: AG00229O MDL No:
Product Description
Catalog Number:
AG00229O
Chemical Name:
Benzoic acid, 3-bromo-5-fluoro-4-nitro-, ethyl ester
CAS Number:
1807208-91-8
Molecular Formula:
C9H7BrFNO4
Molecular Weight:
292.0586
IUPAC Name:
ethyl 3-bromo-5-fluoro-4-nitrobenzoate
InChI:
InChI=1S/C9H7BrFNO4/c1-2-16-9(13)5-3-6(10)8(12(14)15)7(11)4-5/h3-4H,2H2,1H3
InChI Key:
DIOASULLJITKDU-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(F)c(c(c1)Br)[N+](=O)[O-]
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.954g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.06g/mol
Monoisotopic Mass:
290.954g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.1A^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.