(7-hydroxynaphthalen-1-yl) dihydrogen phosphate

C10H9O5P — CID 153322561

IUPAC(7-hydroxynaphthalen-1-yl) dihydrogen phosphate
SMILESO=P(O)(O)Oc1cccc2ccc(O)cc12
InChIInChI=1S/C10H9O5P/c11-8-5-4-7-2-1-3-10(9(7)6-8)15-16(12,13)14/h1-6,11H,(H2,12,13,14)
InChIKeyNRWSIKHVFYDKNS-UHFFFAOYSA-N
MW240.15 g/mol
LogP2.02
Rot. Bonds2

About (7-hydroxynaphthalen-1-yl) dihydrogen phosphate

(7-hydroxynaphthalen-1-yl) dihydrogen phosphate (PubChem CID 153322561) has the molecular formula C10H9O5P and a molecular weight of 240.15 g/mol. Its IUPAC name is (7-hydroxynaphthalen-1-yl) dihydrogen phosphate.

Molecular Properties

Compound Name(7-hydroxynaphthalen-1-yl) dihydrogen phosphate
PubChem CID153322561
Molecular FormulaC10H9O5P
Molecular Weight240.15 g/mol
Exact Mass240.02
IUPAC Name(7-hydroxynaphthalen-1-yl) dihydrogen phosphate
SMILESO=P(O)(O)Oc1cccc2ccc(O)cc12
InChIInChI=1S/C10H9O5P/c11-8-5-4-7-2-1-3-10(9(7)6-8)15-16(12,13)14/h1-6,11H,(H2,12,13,14)
InChIKeyNRWSIKHVFYDKNS-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

(7-hydroxynaphthalen-1-yl) acetate
CID 130034551
benzo[a]anthracen-4-yl dihydrogen phosphate
CID 175921011
(7-hydroxynaphthalen-1-yl) 2-methylprop-2-enoate;yttrium
CID 59524574
[2-(1-phosphonooxynaphthalen-2-yl)naphthalen-1-yl] dihydrogen phosphate
CID 54196807
[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl] dihydrogen phosphate
CID 15162418
(7-hydroxynaphthalen-1-yl) 2,2-dimethylbutanoate
CID 57120356
[2,3-bis(phenylperoxy)phenyl] dihydrogen phosphate
CID 175372696
benzene-1,3-diol;phosphane;phosphono dihydrogen phosphate
CID 174927128
[5-hydroxy-2-[1-hydroxy-2-(4-hydroxyphenyl)ethyl]phenyl] dihydrogen phosphate
CID 22673898
phenanthren-3-ol
CID 73057263
[3-hydroxy-2-[1-hydroxy-2-(4-hydroxyphenyl)ethyl]phenyl] dihydrogen phosphate
CID 22673477
(5-hydroxynaphthalen-2-yl) dihydrogen phosphate
CID 146268458

Frequently Asked Questions

What is the IUPAC name of (7-hydroxynaphthalen-1-yl) dihydrogen phosphate?
The IUPAC name of (7-hydroxynaphthalen-1-yl) dihydrogen phosphate (CID 153322561) is (7-hydroxynaphthalen-1-yl) dihydrogen phosphate.
What is the SMILES notation for (7-hydroxynaphthalen-1-yl) dihydrogen phosphate?
The canonical SMILES for (7-hydroxynaphthalen-1-yl) dihydrogen phosphate is O=P(O)(O)Oc1cccc2ccc(O)cc12.
What is the InChIKey of (7-hydroxynaphthalen-1-yl) dihydrogen phosphate?
The InChIKey is NRWSIKHVFYDKNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9O5P/c11-8-5-4-7-2-1-3-10(9(7)6-8)15-16(12,13)14/h1-6,11H,(H2,12,13,14).
What are the key properties of (7-hydroxynaphthalen-1-yl) dihydrogen phosphate?
(7-hydroxynaphthalen-1-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 (7-hydroxynaphthalen-1-yl) dihydrogen phosphate is sourced from PubChem (CID 153322561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).