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DEAC, SE

CAT: 1410-M35844-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M35844-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
DEAC, SE can be used for relevant research in the field of life sciences. Its product number is T64949 and CAS number is 139346-57-9.
CAS Number
139346-57-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
358.35
Molecular Formula
C18H18N2O6
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

1-((7-(Diethylamino)-2-oxo-2H-1-benzopyran-3-carbonyl)oxy)pyrrolidine-2,5-dione
CAS Number139346-57-9
PubChem CID2760552
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 7-(diethylamino)-2-oxochromene-3-carboxylate
Molecular FormulaC18H18N2O6
Molecular Weight358.3
XLogP1.9
Topological Polar Surface Area93.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count26
Formal Charge0
Complexity638
SMILES
CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)ON3C(=O)CCC3=O
InChI
InChI=1S/C18H18N2O6/c1-3-19(4-2)12-6-5-11-9-13(17(23)25-14(11)10-12)18(24)26-20-15(21)7-8-16(20)22/h5-6,9-10H,3-4,7-8H2,1-2H3
InChIKey
NUNPVRICKDZFLK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-((7-(Diethylamino)-2-oxo-2H-1-benzopyran-3-carbonyl)oxy)pyrrolidine-2,5-dione
CAS: 139346-57-9
CID: 2760552
Formula: C18H18N2O6
MW: 358.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight358.3
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass358.11648630
Monoisotopic Mass358.11648630
Topological Polar Surface Area93.2 Ų
Heavy Atom Count26
Formal Charge0
Complexity638
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

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