dichlorophosphoryloxybenzene

C6H5Cl2O2P — CID 13038

IUPACdichlorophosphoryloxybenzene
SMILESO=P(Cl)(Cl)Oc1ccccc1
InChIInChI=1S/C6H5Cl2O2P/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5H
InChIKeyTXFOLHZMICYNRM-UHFFFAOYSA-N
MW210.98 g/mol
LogP3.65
Rot. Bonds2

About dichlorophosphoryloxybenzene

dichlorophosphoryloxybenzene (PubChem CID 13038) has the molecular formula C6H5Cl2O2P and a molecular weight of 210.98 g/mol. Its IUPAC name is dichlorophosphoryloxybenzene.

Molecular Properties

Compound Namedichlorophosphoryloxybenzene
PubChem CID13038
Molecular FormulaC6H5Cl2O2P
Molecular Weight210.98 g/mol
Exact Mass209.94
IUPAC Namedichlorophosphoryloxybenzene
SMILESO=P(Cl)(Cl)Oc1ccccc1
InChIInChI=1S/C6H5Cl2O2P/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5H
InChIKeyTXFOLHZMICYNRM-UHFFFAOYSA-N
XLogP3.65
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.98
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Triphenyl Phosphate
CID 8289
Phenyl phosphate
CID 12793
Phenolate Sodium
CID 4445035
Phenyl phosphorodiamidate
CID 81954
Diphenyl chlorophosphate
CID 75654
Dibutyl phenyl phosphate
CID 17312
Phosphoric acid, diphenyl ester
CID 13282
Hydron phenoxide
CID 20488062
Diphenyl methylphosphonate
CID 82027
Diphenyl phosphite
CID 62550
Methyl diphenyl phosphate
CID 8291
Diphenyl P-phenylphosphonate
CID 76448

Frequently Asked Questions

What is the IUPAC name of dichlorophosphoryloxybenzene?
The IUPAC name of dichlorophosphoryloxybenzene (CID 13038) is dichlorophosphoryloxybenzene.
What is the SMILES notation for dichlorophosphoryloxybenzene?
The canonical SMILES for dichlorophosphoryloxybenzene is O=P(Cl)(Cl)Oc1ccccc1.
What is the InChIKey of dichlorophosphoryloxybenzene?
The InChIKey is TXFOLHZMICYNRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Cl2O2P/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5H.
What are the key properties of dichlorophosphoryloxybenzene?
dichlorophosphoryloxybenzene has a molecular weight of 210.98 g/mol, XLogP of 3.65, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorophosphoryloxybenzene is sourced from PubChem (CID 13038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).