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Dihydro Uracil-d4

CAT: 0572-TRC-D449993-5MGSize: 5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D449993-5MGSize:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
334473-41-5
Synonyms
2,4(1H,3H)-Pyrimidinedione-5,6-d2, dihydro-d2- (9CI); Dihydro-d2-2,4(1H,3H)-pyrimidinedione-5,6-d2; Hydrouracil-d4; 5,6-Dihydro-2,4(1H,3H)-pyrimidinedione-5,5,6,6-d4; 5,6-Dihydro-2,4-dihydroxypyrimidine-5,5,6,6-d4; 5,6-Dihydrouracil-d4; 5,6-Dihydrouracil-5,5,6,6-D4; Dihydrouracil-d4
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
[2H]C1([2H])NC(=O)NC(=O)C1([2H])[2H]
Molecular Formula
C4 D4 H2 N2 O2
Molecular Weight
118.127
InChI
InChI=1S/C4H6N2O2/c7-3-1-2-5-4(8)6-3/h1-2H2,(H2,5,6,7,8)/i1D2,2D2
Additionnal Information
IUPAC name: 5,5,6,6-tetradeuterio-1,3-diazinane-2,4-dione
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Dihydro Uracil-d4
CAS Number334473-41-5
PubChem CID10678217
IUPAC Name5,5,6,6-tetradeuterio-1,3-diazinane-2,4-dione
Molecular FormulaC4H6N2O2
Molecular Weight118.13
XLogP-1.1
Topological Polar Surface Area58.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity132
SMILES
[2H]C1(C(=O)NC(=O)NC1([2H])[2H])[2H]
InChI
InChI=1S/C4H6N2O2/c7-3-1-2-5-4(8)6-3/h1-2H2,(H2,5,6,7,8)/i1D2,2D2
InChIKey
OIVLITBTBDPEFK-LNLMKGTHSA-N
Chemical Structure
2D Structure
2D structure of Dihydro Uracil-d4
CAS: 334473-41-5
CID: 10678217
Formula: C4H6N2O2
MW: 118.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight118.13
XLogP3-1.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass118.068034422
Monoisotopic Mass118.068034422
Topological Polar Surface Area58.2 Ų
Heavy Atom Count8
Formal Charge0
Complexity132
Isotope Atom Count4
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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