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Acrylic Acid-d3

CAT: 0572-TRC-A191358-2.5MGSize: 2.5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-A191358-2.5MGSize:2.5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
204259-63-2
Synonyms
Acrylic-2,3,3-d3 Acid
Hazard Statement
Flammable liquid and vapour; UN number: UN2218; Packing Group: II
Purity
>95% (GC)
Smiles
OC(/C([2H])=C([2H])/[2H])=O
Molecular Formula
C3HD3O2
Molecular Weight
75.08
Shipping Conditions
Ice Packs
Storage Conditions
-20°C

Chemical Information

Acrylic-2,3,3-D3 acid
CAS Number204259-63-2
PubChem CID22859181
IUPAC Name2,3,3-trideuterioprop-2-enoic acid
Molecular FormulaC3H4O2
Molecular Weight75.08
XLogP0.3
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count5
Formal Charge0
Complexity55
SMILES
[2H]C(=C([2H])C(=O)O)[2H]
InChI
InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)/i1D2,2D
InChIKey
NIXOWILDQLNWCW-FUDHJZNOSA-N
Chemical Structure
2D Structure
2D structure of Acrylic-2,3,3-D3 acid
CAS: 204259-63-2
CID: 22859181
Formula: C3H4O2
MW: 75.08
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight75.08
XLogP30.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass75.039959604
Monoisotopic Mass75.039959604
Topological Polar Surface Area37.3 Ų
Heavy Atom Count5
Formal Charge0
Complexity55.9
Isotope Atom Count3
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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