200,000+ products from a single source!
sales@angenechem.com
140213-11-2 | 3-Butenoic acid, 4-bromo-3,4-diiodo-, ethyl ester
CAS No: 140213-11-2 Catalog No: AG001C5T MDL No:
Product Description
Catalog Number:
AG001C5T
Chemical Name:
3-Butenoic acid, 4-bromo-3,4-diiodo-, ethyl ester
CAS Number:
140213-11-2
Molecular Formula:
C6H7BrI2O2
Molecular Weight:
444.8315
IUPAC Name:
ethyl 4-bromo-3,4-diiodobut-3-enoate
InChI:
InChI=1S/C6H7BrI2O2/c1-2-11-5(10)3-4(8)6(7)9/h2-3H2,1H3
InChI Key:
TXTKBQLTFGSOCW-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(=C(I)Br)I
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
443.772g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
444.833g/mol
Monoisotopic Mass:
443.772g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.