diphenyl hydrogen phosphite;ethanol

C14H17O4P — CID 159674253

IUPACdiphenyl hydrogen phosphite;ethanol
SMILESCCO.OP(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C12H11O3P.C2H6O/c13-16(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12;1-2-3/h1-10,13H;3H,2H2,1H3
InChIKeyMUJVTIBLIPWJFR-UHFFFAOYSA-N
MW280.26 g/mol
LogP3.36
Rot. Bonds4

About diphenyl hydrogen phosphite;ethanol

diphenyl hydrogen phosphite;ethanol (PubChem CID 159674253) has the molecular formula C14H17O4P and a molecular weight of 280.26 g/mol. Its IUPAC name is diphenyl hydrogen phosphite;ethanol.

Molecular Properties

Compound Namediphenyl hydrogen phosphite;ethanol
PubChem CID159674253
Molecular FormulaC14H17O4P
Molecular Weight280.26 g/mol
Exact Mass280.09
IUPAC Namediphenyl hydrogen phosphite;ethanol
SMILESCCO.OP(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C12H11O3P.C2H6O/c13-16(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12;1-2-3/h1-10,13H;3H,2H2,1H3
InChIKeyMUJVTIBLIPWJFR-UHFFFAOYSA-N
XLogP3.36
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.26
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

ethane-1,2-diol;phenyl dihydrogen phosphite
CID 118162360
methylsulfanyl phenyl hydrogen phosphite
CID 175099575
diphenyl hydrogen phosphite;(2-nonylphenyl) dihydrogen phosphite
CID 88805641
diphenyl hydrogen phosphite;oxo(diphenoxy)phosphanium
CID 87382332
2-[hydroxy(phenoxy)phosphanyl]oxyacetic acid
CID 67659805
bis(phenyl dihydrogen phosphite);sulfane
CID 174625507
diphenyl hydrogen phosphite;2-ethylhexyl dihydrogen phosphite
CID 161432608
pent-2-en-3-yl(phenoxy)phosphinous acid
CID 166528009
calcium;hydride;phenyl dihydrogen phosphite
CID 173093871
strontium;hydride;phenyl dihydrogen phosphite
CID 173442477
phenoxy(phenyl)phosphinous acid
CID 21107296
tri(113C)cyclohexatrienyl phosphite
CID 101432390

Frequently Asked Questions

What is the IUPAC name of diphenyl hydrogen phosphite;ethanol?
The IUPAC name of diphenyl hydrogen phosphite;ethanol (CID 159674253) is diphenyl hydrogen phosphite;ethanol.
What is the SMILES notation for diphenyl hydrogen phosphite;ethanol?
The canonical SMILES for diphenyl hydrogen phosphite;ethanol is CCO.OP(Oc1ccccc1)Oc1ccccc1.
What is the InChIKey of diphenyl hydrogen phosphite;ethanol?
The InChIKey is MUJVTIBLIPWJFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11O3P.C2H6O/c13-16(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12;1-2-3/h1-10,13H;3H,2H2,1H3.
What are the key properties of diphenyl hydrogen phosphite;ethanol?
diphenyl hydrogen phosphite;ethanol has a molecular weight of 280.26 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl hydrogen phosphite;ethanol is sourced from PubChem (CID 159674253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).