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2-Ethoxyethanol

CAT: 0127-OR1004256-03Size: 25 gDry Ice: NoHazardous: No
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CAT#:0127-OR1004256-03Size:25 g
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CAS Number
110-80-5
MDL Number
MFCD00002869
Purity
95%
Smiles
CCOCCO

Chemical Information

Glycol monoethyl ether

Ethylene Glycol Monoethyl Ether can cause developmental toxicity and male reproductive toxicity according to an independent committee of scientific and health experts.

CAS Number110-80-5
PubChem CID8076
IUPAC Name2-ethoxyethanol
Molecular FormulaC4H10O2
Molecular Weight90.12
XLogP-0.3
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count6
Formal Charge0
Complexity21
SMILES
CCOCCO
InChI
InChI=1S/C4H10O2/c1-2-6-4-3-5/h5H,2-4H2,1H3
InChIKey
ZNQVEEAIQZEUHB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Glycol monoethyl ether
CAS: 110-80-5
CID: 8076
Formula: C4H10O2
MW: 90.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight90.12
XLogP3-0.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass90.068079557
Monoisotopic Mass90.068079557
Topological Polar Surface Area29.5 Ų
Heavy Atom Count6
Formal Charge0
Complexity21.5
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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