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Ethyl 2- (2-Chloroethoxy) Acetate

CAT: 1299-RG-C081201-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-C081201-01Size:10 mg
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CAS Number
17229-14-0
Synonyms
Ethyl 2- (2-chloroethoxy) acetate
Molecular Formula
C6H11ClO3
Molecular Weight
166.6
Product Name Synonym
Ethyl 2- (2-chloroethoxy) acetate

Chemical Information

Ethyl 2-(2-chloroethoxy)acetate
CAS Number17229-14-0
PubChem CID10964894
IUPAC Nameethyl 2-(2-chloroethoxy)acetate
Molecular FormulaC6H11ClO3
Molecular Weight166.60
XLogP1
Topological Polar Surface Area35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count10
Formal Charge0
Complexity95
SMILES
CCOC(=O)COCCCl
InChI
InChI=1S/C6H11ClO3/c1-2-10-6(8)5-9-4-3-7/h2-5H2,1H3
InChIKey
CVYKQPLWSDHSSV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl 2-(2-chloroethoxy)acetate
CAS: 17229-14-0
CID: 10964894
Formula: C6H11ClO3
MW: 166.60
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight166.60
XLogP31
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass166.0396719
Monoisotopic Mass166.0396719
Topological Polar Surface Area35.5 Ų
Heavy Atom Count10
Formal Charge0
Complexity95
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes