(5-hydroxynaphthalen-2-yl) dihydrogen phosphate

C10H9O5P — CID 146268458

IUPAC(5-hydroxynaphthalen-2-yl) dihydrogen phosphate
SMILESO=P(O)(O)Oc1ccc2c(O)cccc2c1
InChIInChI=1S/C10H9O5P/c11-10-3-1-2-7-6-8(4-5-9(7)10)15-16(12,13)14/h1-6,11H,(H2,12,13,14)
InChIKeyTVKYDODCSGMFSB-UHFFFAOYSA-N
MW240.15 g/mol
LogP2.02
Rot. Bonds2

About (5-hydroxynaphthalen-2-yl) dihydrogen phosphate

(5-hydroxynaphthalen-2-yl) dihydrogen phosphate (PubChem CID 146268458) has the molecular formula C10H9O5P and a molecular weight of 240.15 g/mol. Its IUPAC name is (5-hydroxynaphthalen-2-yl) dihydrogen phosphate.

Molecular Properties

Compound Name(5-hydroxynaphthalen-2-yl) dihydrogen phosphate
PubChem CID146268458
Molecular FormulaC10H9O5P
Molecular Weight240.15 g/mol
Exact Mass240.02
IUPAC Name(5-hydroxynaphthalen-2-yl) dihydrogen phosphate
SMILESO=P(O)(O)Oc1ccc2c(O)cccc2c1
InChIInChI=1S/C10H9O5P/c11-10-3-1-2-7-6-8(4-5-9(7)10)15-16(12,13)14/h1-6,11H,(H2,12,13,14)
InChIKeyTVKYDODCSGMFSB-UHFFFAOYSA-N
XLogP2.02
TPSA86.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.15
LogP ≤ 52.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

disodium;naphthalen-1-ol;naphthalen-2-yl phosphate
CID 159176752
bis(naphthalen-1-ol);phosphoric acid
CID 174499172
sodium naphthalen-2-yl hydrogen phosphate
CID 23700943
benzo[a]anthracen-4-yl dihydrogen phosphate
CID 175921011
(3-phosphonooxyphenyl) phosphate
CID 20547233
[6-(hydroxymethyl)naphthalen-2-yl] dihydrogen phosphate
CID 146268446
sodium;hydride;naphthalen-1-ol;phosphoric acid
CID 174705460
6-pentoxynaphthalen-1-ol
CID 22144289
(7-hydroxynaphthalen-1-yl) dihydrogen phosphate
CID 153322561
[3-(4-methylphenoxy)phenyl] dihydrogen phosphate
CID 19105360
[3-[(1E,4E)-3-oxo-5-(3-phosphonooxyphenyl)penta-1,4-dienyl]phenyl] dihydrogen phosphate
CID 56838042
(3-acetylphenyl) dihydrogen phosphate
CID 57284655

Frequently Asked Questions

What is the IUPAC name of (5-hydroxynaphthalen-2-yl) dihydrogen phosphate?
The IUPAC name of (5-hydroxynaphthalen-2-yl) dihydrogen phosphate (CID 146268458) is (5-hydroxynaphthalen-2-yl) dihydrogen phosphate.
What is the SMILES notation for (5-hydroxynaphthalen-2-yl) dihydrogen phosphate?
The canonical SMILES for (5-hydroxynaphthalen-2-yl) dihydrogen phosphate is O=P(O)(O)Oc1ccc2c(O)cccc2c1.
What is the InChIKey of (5-hydroxynaphthalen-2-yl) dihydrogen phosphate?
The InChIKey is TVKYDODCSGMFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9O5P/c11-10-3-1-2-7-6-8(4-5-9(7)10)15-16(12,13)14/h1-6,11H,(H2,12,13,14).
What are the key properties of (5-hydroxynaphthalen-2-yl) dihydrogen phosphate?
(5-hydroxynaphthalen-2-yl) dihydrogen phosphate has a molecular weight of 240.15 g/mol, XLogP of 2.02, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-hydroxynaphthalen-2-yl) dihydrogen phosphate is sourced from PubChem (CID 146268458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).