(2-phenylphenyl) dimethylphosphorylformate

C15H15O3P — CID 122645320

IUPAC(2-phenylphenyl) dimethylphosphorylformate
SMILESCP(C)(=O)C(=O)Oc1ccccc1-c1ccccc1
InChIInChI=1S/C15H15O3P/c1-19(2,17)15(16)18-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-11H,1-2H3
InChIKeyCNKBXECYWBXCKP-UHFFFAOYSA-N
MW274.26 g/mol
LogP4.48
Rot. Bonds3

About (2-phenylphenyl) dimethylphosphorylformate

(2-phenylphenyl) dimethylphosphorylformate (PubChem CID 122645320) has the molecular formula C15H15O3P and a molecular weight of 274.26 g/mol. Its IUPAC name is (2-phenylphenyl) dimethylphosphorylformate.

Molecular Properties

Compound Name(2-phenylphenyl) dimethylphosphorylformate
PubChem CID122645320
Molecular FormulaC15H15O3P
Molecular Weight274.26 g/mol
Exact Mass274.08
IUPAC Name(2-phenylphenyl) dimethylphosphorylformate
SMILESCP(C)(=O)C(=O)Oc1ccccc1-c1ccccc1
InChIInChI=1S/C15H15O3P/c1-19(2,17)15(16)18-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-11H,1-2H3
InChIKeyCNKBXECYWBXCKP-UHFFFAOYSA-N
XLogP4.48
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.26
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl (2-phenylphenyl) hydrogen phosphate
CID 142726316
(2-phenylphenyl) dihydrogen phosphate
CID 19371408
(2-phenylphenyl) cyclopropanecarboxylate
CID 91695306
(2-phenylphenoxy)carbonylsulfonylformic acid
CID 54171746
diazulen-1-yl butanedioate
CID 91384946
(2-phenylphenyl) hex-2-ynoate
CID 70487563
1-[chloro-(2-phenylphenoxy)phosphoryl]oxy-2-phenylbenzene
CID 21469895
cyclopentyl (2-phenylphenyl) carbonate
CID 121311469
(2-phenylphenyl) N-anilinocarbamate
CID 151770788
dimethyl-bis(2-phenylphenoxy)silane
CID 91734394
(2-phenylphenyl) thiophene-2-carboxylate
CID 922979
bis[2-[4-(2-phenylpropan-2-yl)phenyl]phenyl] carbonate
CID 66629129

Frequently Asked Questions

What is the IUPAC name of (2-phenylphenyl) dimethylphosphorylformate?
The IUPAC name of (2-phenylphenyl) dimethylphosphorylformate (CID 122645320) is (2-phenylphenyl) dimethylphosphorylformate.
What is the SMILES notation for (2-phenylphenyl) dimethylphosphorylformate?
The canonical SMILES for (2-phenylphenyl) dimethylphosphorylformate is CP(C)(=O)C(=O)Oc1ccccc1-c1ccccc1.
What is the InChIKey of (2-phenylphenyl) dimethylphosphorylformate?
The InChIKey is CNKBXECYWBXCKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15O3P/c1-19(2,17)15(16)18-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-11H,1-2H3.
What are the key properties of (2-phenylphenyl) dimethylphosphorylformate?
(2-phenylphenyl) dimethylphosphorylformate has a molecular weight of 274.26 g/mol, XLogP of 4.48, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenylphenyl) dimethylphosphorylformate is sourced from PubChem (CID 122645320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).