Methyl 2,2-dichloro-2-methoxyacetate - CAS 17640-25-4

Name: Methyl 2,2-dichloro-2-methoxyacetate
Brand: BOC Sciences
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Catalog:	BB013220
Product Name:	Methyl 2,2-dichloro-2-methoxyacetate
CAS:	17640-25-4
Synonyms:	methyl 2,2-dichloro-2-methoxyacetate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	methyl 2,2-dichloro-2-methoxyacetate
Description:	Methyl 2,2-dichloro-2-methoxyacetate (CAS# 17640-25-4) is a useful research chemical.
Molecular Weight:	172.99
Molecular Formula:	C4H6Cl2O3
Canonical SMILES:	COC(=O)C(OC)(Cl)Cl
InChI:	InChI=1S/C4H6Cl2O3/c1-8-3(7)4(5,6)9-2/h1-2H3
InChI Key:	FWIGIASHGJFYOL-UHFFFAOYSA-N
Boiling Point:	180 °C at 760 mmHg
Density:	1.36 g/mL at 25°C(lit.)
MDL:	MFCD00012202
LogP:	0.93720

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]C9H8O2
Oxiran-2-yl(phenyl)methanone
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

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

Publication Number	Title	Priority Date
WO-2020200161-A1	Salt of indazolyl-containing tricyclic derivative and crystal form thereof	20190402
EP-3728423-A1	Polymeric compositions prepared with a controlled radical initiator	20171221
US-2020308321-A1	Polymeric compositions prepared with a controlled radical initiator	20171221
US-10913807-B2	Polymeric compositions prepared with a controlled radical initiator	20171221
EP-3728424-A1	Polymeric substrates with attached thiocarbonylthio-containing groups	20171220

Complexity:	112
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.9693994
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	171.9693994
Rotatable Bond Count:	3
Topological Polar Surface Area:	35.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2