200,000+ products from a single source!
sales@angenechem.com
881015-10-7 | 2-Butenoic acid, 4-(2-iodophenoxy)-, ethyl ester, (2E)-
CAS No: 881015-10-7 Catalog No: AG004J1O MDL No:
Product Description
Catalog Number:
AG004J1O
Chemical Name:
2-Butenoic acid, 4-(2-iodophenoxy)-, ethyl ester, (2E)-
CAS Number:
881015-10-7
Molecular Formula:
C12H13IO3
Molecular Weight:
332.1343
IUPAC Name:
ethyl 4-(2-iodophenoxy)but-2-enoate
InChI:
InChI=1S/C12H13IO3/c1-2-15-12(14)8-5-9-16-11-7-4-3-6-10(11)13/h3-8H,2,9H2,1H3
InChI Key:
ZPVOGNHELYLFIT-UHFFFAOYSA-N
SMILES:
CCOC(=O)/C=C/COc1ccccc1I
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.991g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
332.137g/mol
Monoisotopic Mass:
331.991g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.