200,000+ products from a single source!
sales@angenechem.com
898777-12-3 | ETHYL 5-(2-IODOPHENYL)-5-OXOVALERATE
CAS No: 898777-12-3 Catalog No: AG006JWH MDL No:
Product Description
Catalog Number:
AG006JWH
Chemical Name:
ETHYL 5-(2-IODOPHENYL)-5-OXOVALERATE
CAS Number:
898777-12-3
Molecular Formula:
C13H15IO3
Molecular Weight:
346.1609
IUPAC Name:
ethyl 5-(2-iodophenyl)-5-oxopentanoate
InChI:
InChI=1S/C13H15IO3/c1-2-17-13(16)9-5-8-12(15)10-6-3-4-7-11(10)14/h3-4,6-7H,2,5,8-9H2,1H3
InChI Key:
ZXQLRAPIGKOXIO-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCC(=O)c1ccccc1I
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.007g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.164g/mol
Monoisotopic Mass:
346.007g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.