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1,2-Propanediol Diglycidyl Ether

CAT: 0572-TRC-P760318-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-P760318-250MGSize:250 mg
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CAS Number
16096-30-3
Hazard Statement
Harmful if swallowed
Smiles
CC(COCC1CO1)OCC2CO2
Molecular Formula
C9 H16 O4
Molecular Weight
188.221
InChI
InChI=1S/C9H16O4/c1-7(11-4-9-6-13-9)2-10-3-8-5-12-8/h7-9H,2-6H2,1H3
Additionnal Information
IUPAC name: 2-[1-(oxiran-2-ylmethoxy)propan-2-yloxymethyl]oxirane
Shipping Conditions
Room Temperature

Chemical Information

Propylene glycol diglycidyl ether homopolymer

See also: Polypropyleneglycol diglycidyl ether (annotation moved to).

CAS Number16096-30-3
PubChem CID85959
IUPAC Name2-[1-(oxiran-2-ylmethoxy)propan-2-yloxymethyl]oxirane
Molecular FormulaC9H16O4
Molecular Weight188.22
XLogP-0.3
Topological Polar Surface Area43.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count13
Formal Charge0
Complexity162
SMILES
CC(COCC1CO1)OCC2CO2
InChI
InChI=1S/C9H16O4/c1-7(11-4-9-6-13-9)2-10-3-8-5-12-8/h7-9H,2-6H2,1H3
InChIKey
HDPLHDGYGLENEI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propylene glycol diglycidyl ether homopolymer
CAS: 16096-30-3
CID: 85959
Formula: C9H16O4
MW: 188.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight188.22
XLogP3-0.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass188.10485899
Monoisotopic Mass188.10485899
Topological Polar Surface Area43.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity162
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes