2-Chloroethoxyacetic acid - CAS 14869-41-1

Catalog:	BB010334
Product Name:	2-Chloroethoxyacetic acid
CAS:	14869-41-1
Synonyms:	2-(2-chloroethoxy)acetic acid; 2-(2-chloroethoxy)acetic acid

Technical Data

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Computed Properties

IUPAC Name:	2-(2-chloroethoxy)acetic acid
Description:	A metabolite of Bis(2-chloroethyl) Ether.
Molecular Weight:	138.55
Molecular Formula:	C4H7ClO3
Canonical SMILES:	C(CCl)OCC(=O)O
InChI:	InChI=1S/C4H7ClO3/c5-1-2-8-3-4(6)7/h1-3H2,(H,6,7)
InChI Key:	MHXJETVNZPUVEN-UHFFFAOYSA-N
Boiling Point:	289.753 °C at 760 mmHg
Density:	1.296 g/cm³
Appearance:	Liquid
Storage:	Store at -20°C
MDL:	MFCD17014832
LogP:	0.32640

Publication Number	Title	Priority Date
CN-110988163-A	Method for separating and determining levocetirizine hydrochloride and genotoxic impurity E thereof by HPLC method	20191129
WO-2020169604-A1	Pyridazines herbicidal compounds	20190221
CN-113423704-A	Pyridazine herbicidal compounds	20190221
WO-2020165321-A1	Herbicidal compounds	20190215
CN-113423274-A	Herbicidal compounds	20190215

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Related Functional Groups

Carbonyl Compounds

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[87-88-7]
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[17746-05-3]
Undecanoyl chloride
[70199-62-1]
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[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid

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GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	73.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	138.0083718
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	138.0083718
Rotatable Bond Count:	4
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3