Ethyl 4-Iodobutyrate - CAS 7425-53-8

Catalog:	BB035036
Product Name:	Ethyl 4-Iodobutyrate
CAS:	7425-53-8
Synonyms:	4-iodobutanoic acid ethyl ester; ethyl 4-iodobutanoate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 4-iodobutanoate
Description:	Ethyl 4-Iodobutyrate (CAS# 7425-53-8) is a useful research chemical.
Molecular Weight:	242.05
Molecular Formula:	C6H11IO2
Canonical SMILES:	CCOC(=O)CCCI
InChI:	InChI=1S/C6H11IO2/c1-2-9-6(8)4-3-5-7/h2-5H2,1H3
InChI Key:	RLZFVPPGVAHZPE-UHFFFAOYSA-N
Boiling Point:	219.6 °C at 760 mmHg
Density:	1.614 g/cm³
MDL:	MFCD00045325
LogP:	1.76470

Publication Number	Title	Priority Date
CN-110878036-A	Preparation method of [ (1, 2-disulfonyl) ethyl ] aromatic compound	20190910
JP-2020176254-A	Photopolymerizable composition, coating film containing the photopolymerizable composition, and curing method thereof	20190415
JP-2020172599-A	A photoradical polymerizable composition containing a photoradical curing oxygen inhibition reducing agent, a photoradical curing oxygen inhibition reducing agent, a coating film containing a photoradical curing oxygen inhibition reducing agent, and a curing method thereof.	20190411
WO-2020121384-A1	Photopolymerization sensitizer having migration resistance	20181210
WO-2020121544-A1	Migration-resistant photopolymerization sensitizer	20181210

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Complexity:	83.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	241.98038
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	241.98038
Rotatable Bond Count:	5
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1