200,000+ products from a single source!
sales@angenechem.com
674776-89-7 | Benzoic acid, 2-iodyl-, ethyl ester
CAS No: 674776-89-7 Catalog No: AG006GR6 MDL No:
Product Description
Catalog Number:
AG006GR6
Chemical Name:
Benzoic acid, 2-iodyl-, ethyl ester
CAS Number:
674776-89-7
Molecular Formula:
C9H9IO4
Molecular Weight:
308.0698
IUPAC Name:
ethyl 2-iodylbenzoate
InChI:
InChI=1S/C9H9IO4/c1-2-14-9(11)7-5-3-4-6-8(7)10(12)13/h3-6H,2H2,1H3
InChI Key:
PSAURZHBFQDTLR-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccccc1[I](=O)=O
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.955g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.071g/mol
Monoisotopic Mass:
307.955g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.