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Propynol Ethoxylate (>80%)

CAT: 0572-TRC-P838375-10GSize: 10 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-P838375-10GSize:10 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3973-18-0
Synonyms
2-(2-Propyn-1-yloxy)ethanol; 2-(2-Propynyloxy)ethanol; 2-Propynoxyethanol; 3-(2-Hydroxyethoxy)-1-propyne; 4-Oxa-1-hexyn-6-ol; Ethylene Glycol Monopropargyl Ether
Hazard Statement
Combustible liquid and vapour.
Smiles
OCCOCC#C
Molecular Formula
C5H8O2
Molecular Weight
100.12
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

2-Propynoxyethanol
CAS Number3973-18-0
PubChem CID77596
IUPAC Name2-prop-2-ynoxyethanol
Molecular FormulaC5H8O2
Molecular Weight100.12
XLogP-0.5
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count7
Formal Charge0
Complexity69
SMILES
C#CCOCCO
InChI
InChI=1S/C5H8O2/c1-2-4-7-5-3-6/h1,6H,3-5H2
InChIKey
GHGCQQRMJCSIBQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Propynoxyethanol
CAS: 3973-18-0
CID: 77596
Formula: C5H8O2
MW: 100.12
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight100.12
XLogP3-0.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass100.052429494
Monoisotopic Mass100.052429494
Topological Polar Surface Area29.5 Ų
Heavy Atom Count7
Formal Charge0
Complexity69.4
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