200,000+ products from a single source!
sales@angenechem.com
251477-23-3 | Benzoic acid, 3-bromo-4-hydroxy-5-iodo-, ethyl ester
CAS No: 251477-23-3 Catalog No: AG002QMS MDL No:
Product Description
Catalog Number:
AG002QMS
Chemical Name:
Benzoic acid, 3-bromo-4-hydroxy-5-iodo-, ethyl ester
CAS Number:
251477-23-3
Molecular Formula:
C9H8BrIO3
Molecular Weight:
370.9665
IUPAC Name:
ethyl 3-bromo-4-hydroxy-5-iodobenzoate
InChI:
InChI=1S/C9H8BrIO3/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3-4,12H,2H2,1H3
InChI Key:
MCHJDNHUOQYCKO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(Br)c(c(c1)I)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:
369.87g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
370.968g/mol
Monoisotopic Mass:
369.87g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.