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4-Methylumbelliferyl phosphate dilithium

CAT: 0013-GTR19247390-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19247390-01Size:100 mg
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Description
4-Methylumbelliferyl phosphate dilithium is a reagent used in biochemical reactions.
CAS Number
125328-83-8
Smiles
O=C1OC2=C (C (C) =C1) C=CC (OP (O[Li]) (O[Li]) =O) =C2
Molecular Formula
C10H7Li2O6P
Molecular Weight
268.02
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Lithium 4-methyl-2-oxo-2H-chromen-7-yl phosphate
CAS Number125328-83-8
PubChem CID6097229
IUPAC Namedilithium;(4-methyl-2-oxochromen-7-yl) phosphate
Molecular FormulaC10H7Li2O6P
Molecular Weight268.1
Topological Polar Surface Area98.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Heavy Atom Count19
Formal Charge0
Complexity386
SMILES
[Li+].[Li+].CC1=CC(=O)OC2=C1C=CC(=C2)OP(=O)([O-])[O-]
InChI
InChI=1S/C10H9O6P.2Li/c1-6-4-10(11)15-9-5-7(2-3-8(6)9)16-17(12,13)14;;/h2-5H,1H3,(H2,12,13,14);;/q;2*+1/p-2
InChIKey
SNYWUWHQGOCFJJ-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Lithium 4-methyl-2-oxo-2H-chromen-7-yl phosphate
CAS: 125328-83-8
CID: 6097229
Formula: C10H7Li2O6P
MW: 268.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight268.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass268.03003181
Monoisotopic Mass268.03003181
Topological Polar Surface Area98.7 Ų
Heavy Atom Count19
Formal Charge0
Complexity386
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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