2-Propenoic acid, 3-iodo-, (2E)-


Chemical Name: 2-Propenoic acid, 3-iodo-, (2E)-
CAS Number: 6372-02-7
Product Number: AG003C0M(AGN-PC-0OECUI)
Synonyms:
MDL No:
Molecular Formula: C3H3IO2
Molecular Weight: 197.9592

Identification/Properties


Properties
MP:
144-147 °C
BP:
248.3±23.0 °C(Predicted)
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
197.959g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
197.918g/mol
Monoisotopic Mass:
197.918g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
76.9
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3261
Hazard Statements:
H314
Precautionary Statements:
P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P405-P501
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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