Bis[2-(2-chloroethoxy)ethyl] ether - CAS 638-56-2

Catalog:	BB032303
Product Name:	Bis[2-(2-chloroethoxy)ethyl] ether
CAS:	638-56-2
Synonyms:	1-(2-chloroethoxy)-2-[2-(2-chloroethoxy)ethoxy]ethane

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Computed Properties

IUPAC Name:	1-(2-chloroethoxy)-2-[2-(2-chloroethoxy)ethoxy]ethane
Description:	Bis[2-(2-chloroethoxy)ethyl] ether (CAS# 638-56-2) is a useful research chemical.
Molecular Weight:	231.12
Molecular Formula:	C8H16Cl2O3
Canonical SMILES:	C(COCCCl)OCCOCCCl
InChI:	InChI=1S/C8H16Cl2O3/c9-1-3-11-5-7-13-8-6-12-4-2-10/h1-8H2
InChI Key:	ZCFRYTWBXNQVOW-UHFFFAOYSA-N
Boiling Point:	297.8 °C at 760 mmHg
Density:	1.18 g/mL at 20°C(lit.)
MDL:	MFCD00054473
LogP:	1.51380

Publication Number	Title	Priority Date
CN-112877072-A	Long-acting agriculture and forestry water-retaining agent and preparation method thereof	20210114
CN-112473396-A	Anion exchange membrane material for diffusion dialysis acid recovery and preparation method thereof	20201127
CN-110951076-A	Hyperbranched polyetherimide and preparation and application thereof	20191022
CN-110951076-B	Hyperbranched polyetherimide and preparation and application thereof	20191022
WO-2020117373-A1	Pharmaceutical compositions comprising anti-191p4d12 antibody drug conjugates and methods of use thereof	20181203

PMID	Publication Date	Title	Journal
21577943	20090919	4-Phenyl-9,12,15-trioxa-1,5,6,18-tetra-azatetra-cyclo-[16.6.1.0.0]penta-conta-2,4,19,21,23-pentaen-25-one	Acta crystallographica. Section E, Structure reports online

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GHS Hazard Statement:	H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P310, P302+P352, P312, P321, P322, P330, P363, P405, and P501
Signal Word:	Danger

Complexity:	83.5
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	230.0476498
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	230.0476498
Rotatable Bond Count:	10
Topological Polar Surface Area:	27.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1