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Acluracil

CAT: 0931-T29611-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T29611-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
20938-38-9
Target
Others
Related Pathways
Others
Bioactivity
Acluracil is a biochemical.
Smiles
O=C1C(=C(Cl)N(C(=O)N1CC)CC=C)CC
Molecular Formula
C11H15ClN2O2
Molecular Weight
242.7
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Acluracil

structure

CAS Number20938-38-9
PubChem CID159901
IUPAC Name6-chloro-3,5-diethyl-1-prop-2-enylpyrimidine-2,4-dione
Molecular FormulaC11H15ClN2O2
Molecular Weight242.70
XLogP2
Topological Polar Surface Area40.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count16
Formal Charge0
Complexity363
SMILES
CCC1=C(N(C(=O)N(C1=O)CC)CC=C)Cl
InChI
InChI=1S/C11H15ClN2O2/c1-4-7-14-9(12)8(5-2)10(15)13(6-3)11(14)16/h4H,1,5-7H2,2-3H3
InChIKey
GPSWWJCFLZMBGB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Acluracil
CAS: 20938-38-9
CID: 159901
Formula: C11H15ClN2O2
MW: 242.70
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight242.70
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass242.0822054
Monoisotopic Mass242.0822054
Topological Polar Surface Area40.6 Ų
Heavy Atom Count16
Formal Charge0
Complexity363
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

Alternative Products

CatalogName
MBS5779244Acluracil

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