2-(2-phenylethenyl)phenol;phosphoric acid

C14H15O5P — CID 67814298

IUPAC2-(2-phenylethenyl)phenol;phosphoric acid
SMILESO=P(O)(O)O.Oc1ccccc1C=Cc1ccccc1
InChIInChI=1S/C14H12O.H3O4P/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12;1-5(2,3)4/h1-11,15H;(H3,1,2,3,4)
InChIKeyYRWUZYRIVWKHRK-UHFFFAOYSA-N
MW294.24 g/mol
LogP2.63
Rot. Bonds2

About 2-(2-phenylethenyl)phenol;phosphoric acid

2-(2-phenylethenyl)phenol;phosphoric acid (PubChem CID 67814298) has the molecular formula C14H15O5P and a molecular weight of 294.24 g/mol. Its IUPAC name is 2-(2-phenylethenyl)phenol;phosphoric acid.

Molecular Properties

Compound Name2-(2-phenylethenyl)phenol;phosphoric acid
PubChem CID67814298
Molecular FormulaC14H15O5P
Molecular Weight294.24 g/mol
Exact Mass294.07
IUPAC Name2-(2-phenylethenyl)phenol;phosphoric acid
SMILESO=P(O)(O)O.Oc1ccccc1C=Cc1ccccc1
InChIInChI=1S/C14H12O.H3O4P/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12;1-5(2,3)4/h1-11,15H;(H3,1,2,3,4)
InChIKeyYRWUZYRIVWKHRK-UHFFFAOYSA-N
XLogP2.63
TPSA97.99 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.24
LogP ≤ 52.63
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-phenylethenyl)-2-[2-(2-phenylethenyl)phenoxy]benzene;phosphoric acid
CID 155345886
4-[2-(2-hydroxyphenyl)ethenyl]benzene-1,2-diol
CID 54133293
bis(1,2-bis[(E)-2-phenylethenyl]benzene);sulfane
CID 68618408
2-(2-phenylethenyl)benzene-1,4-diol
CID 54196246
2-chloro-3-(2-phenylethenyl)phenol
CID 70555314
CID 172791684
CID 172791684
2-[(E)-2-[1-[(E)-3-phenylprop-2-enyl]pyridin-1-ium-4-yl]ethenyl]phenol bromide
CID 21235860
3-[2-(2-phenylethenyl)phenyl]prop-2-enoic acid
CID 70472676
but-2-enedioic acid;2,3,4-tris(2-phenylethenyl)phenol
CID 159401430
tetrakis[2-[(E)-2-phenylethenyl]phenyl]silane
CID 22630526
(Z)-3-(2-hydroxyphenyl)prop-2-enoic acid
CID 5280841
2-[[4-(2-phenylethenyl)phenyl]iminomethyl]phenol
CID 3812353

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylethenyl)phenol;phosphoric acid?
The IUPAC name of 2-(2-phenylethenyl)phenol;phosphoric acid (CID 67814298) is 2-(2-phenylethenyl)phenol;phosphoric acid.
What is the SMILES notation for 2-(2-phenylethenyl)phenol;phosphoric acid?
The canonical SMILES for 2-(2-phenylethenyl)phenol;phosphoric acid is O=P(O)(O)O.Oc1ccccc1C=Cc1ccccc1.
What is the InChIKey of 2-(2-phenylethenyl)phenol;phosphoric acid?
The InChIKey is YRWUZYRIVWKHRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O.H3O4P/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12;1-5(2,3)4/h1-11,15H;(H3,1,2,3,4).
What are the key properties of 2-(2-phenylethenyl)phenol;phosphoric acid?
2-(2-phenylethenyl)phenol;phosphoric acid has a molecular weight of 294.24 g/mol, XLogP of 2.63, 2 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylethenyl)phenol;phosphoric acid is sourced from PubChem (CID 67814298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).