ethyl 3-chloro-4-iodobenzoate


Chemical Name: ethyl 3-chloro-4-iodobenzoate
CAS Number: 874831-02-4
Product Number: AG00GZNU(AGN-PC-05F1HJ)
Synonyms:
MDL No:
Molecular Formula: C9H8ClIO2
Molecular Weight: 310.51609

Identification/Properties


Computed Properties
Molecular Weight:
310.515g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
309.926g/mol
Monoisotopic Mass:
309.926g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
187
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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