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1-Naphthyl phosphate

CAT: 0024-sc-229804Size: 1 gDry Ice: NoHazardous: No
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CAS Number
1136-89-6

Chemical Information

Naphthyl phosphate

1-naphthyl dihydrogen phosphate is an aryl phosphate resulting from the formal condensation of phosphoric acid with 1 mol eq. of 1-naphthol. It is a substrate for phosphatase.

CAS Number1136-89-6
PubChem CID2115
IUPAC Namenaphthalen-1-yl dihydrogen phosphate
Molecular FormulaC10H9O4P
Molecular Weight224.15
XLogP2
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity262
SMILES
C1=CC=C2C(=C1)C=CC=C2OP(=O)(O)O
InChI
InChI=1S/C10H9O4P/c11-15(12,13)14-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H2,11,12,13)
InChIKey
YNXICDMQCQPQEW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Naphthyl phosphate
CAS: 1136-89-6
CID: 2115
Formula: C10H9O4P
MW: 224.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight224.15
XLogP32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass224.02384576
Monoisotopic Mass224.02384576
Topological Polar Surface Area66.8 Ų
Heavy Atom Count15
Formal Charge0
Complexity262
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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