200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1261649-45-9
1261649-45-9 | Benzenepropanoic acid, 4-bromo-2-iodo-
CAS No: 1261649-45-9 Catalog No: AG000RXS MDL No:
Product Description
Catalog Number:
AG000RXS
Chemical Name:
Benzenepropanoic acid, 4-bromo-2-iodo-
CAS Number:
1261649-45-9
Molecular Formula:
C9H8BrIO2
Molecular Weight:
354.9671
IUPAC Name:
3-(4-bromo-2-iodophenyl)propanoic acid
InChI:
InChI=1S/C9H8BrIO2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1,3,5H,2,4H2,(H,12,13)
InChI Key:
FOXHYZXIEMSWQL-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccc(cc1I)Br
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.875g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
354.969g/mol
Monoisotopic Mass:
353.875g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.