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Ethyl Carbitol Acetate

CAT: 0572-TRC-E495975-25GSize: 25 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-E495975-25GSize:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
112-15-2
Synonyms
2-(2-Ethoxyethoxy)ethyl Acetate; Carbitol acetate; Diethylene Glycol Ethyl Ether Acetate; Ektasolve DE acetate; NSC 8702NSC 870
Hazard Statement
Causes serious eye irritation.
Smiles
CCOCCOCCOC(=O)C
Molecular Formula
C8 H16 O4
Molecular Weight
176.21
InChI
InChI=1S/C8H16O4/c1-3-10-4-5-11-6-7-12-8(2)9/h3-7H2,1-2H3
Additionnal Information
IUPAC name: 2-(2-ethoxyethoxy)ethyl acetate
Shipping Conditions
Room Temperature
Storage Conditions
+20°C

Chemical Information

2-(2-Ethoxyethoxy)ethyl acetate

Diethylene glycol ethyl ether acetate is a colorless liquid. (USCG, 1999)

CAS Number112-15-2
PubChem CID8165
IUPAC Name2-(2-ethoxyethoxy)ethyl acetate
Molecular FormulaC8H16O4
Molecular Weight176.21
XLogP0.2
Topological Polar Surface Area44.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count12
Formal Charge0
Complexity114
SMILES
CCOCCOCCOC(=O)C
InChI
InChI=1S/C8H16O4/c1-3-10-4-5-11-6-7-12-8(2)9/h3-7H2,1-2H3
InChIKey
FPZWZCWUIYYYBU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-Ethoxyethoxy)ethyl acetate
CAS: 112-15-2
CID: 8165
Formula: C8H16O4
MW: 176.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight176.21
XLogP30.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass176.10485899
Monoisotopic Mass176.10485899
Topological Polar Surface Area44.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity114
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

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