4-phenyl-1,4lambda5-oxaphosphinane 4-oxide

C10H13O2P — CID 4134640

IUPAC4-phenyl-1,4lambda5-oxaphosphinane 4-oxide
SMILESO=P1(c2ccccc2)CCOCC1
InChIInChI=1S/C10H13O2P/c11-13(8-6-12-7-9-13)10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKeySVSWBELTSKUCCP-UHFFFAOYSA-N
MW196.19 g/mol
LogP1.71
Rot. Bonds1

About 4-phenyl-1,4lambda5-oxaphosphinane 4-oxide

4-phenyl-1,4lambda5-oxaphosphinane 4-oxide (PubChem CID 4134640) has the molecular formula C10H13O2P and a molecular weight of 196.19 g/mol. Its IUPAC name is 4-phenyl-1,4lambda5-oxaphosphinane 4-oxide.

Molecular Properties

Compound Name4-phenyl-1,4lambda5-oxaphosphinane 4-oxide
PubChem CID4134640
Molecular FormulaC10H13O2P
Molecular Weight196.19 g/mol
Exact Mass196.07
IUPAC Name4-phenyl-1,4lambda5-oxaphosphinane 4-oxide
SMILESO=P1(c2ccccc2)CCOCC1
InChIInChI=1S/C10H13O2P/c11-13(8-6-12-7-9-13)10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKeySVSWBELTSKUCCP-UHFFFAOYSA-N
XLogP1.71
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.19
LogP ≤ 51.71
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

2-phenyl-1,2λ5-oxaphosphirane 2-oxide
CID 91007999
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CID 3663884
3-[2-(1-oxo-1-phenyl-1λ5-phospholan-3-yl)ethyl]-1-phenyl-1λ5-phospholane 1-oxide
CID 132561705
CID 59360341
CID 59360341
2-phenyl-6-oxa-2λ5-phosphabicyclo[3.1.0]hexane 2-oxide
CID 102257098
(5S,6S)-5,6-dibromo-1-oxo-1-phenyl-1λ5-phosphonane-3,8-dione
CID 23415921
3-bromo-4-methyl-1-phenyl-1λ5-phospholane 1-oxide
CID 102170737
oxolane;phenoxybenzene
CID 22620896
4,7,13,16,21,24-hexaoxa-1λ5,10λ5-diphosphabicyclo[8.8.8]hexacosane 1,10-dioxide
CID 12037889
1-oxo-1-phenyl-1λ5-phospholane-2,3-dione
CID 66641409
1-phenyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-1λ5-phosphinine 1-oxide
CID 13030119
1,3-dibenzyl-5-phenyl-1,3,5lambda5-diazaphosphinane 5-oxide
CID 3058098

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-1,4lambda5-oxaphosphinane 4-oxide?
The IUPAC name of 4-phenyl-1,4lambda5-oxaphosphinane 4-oxide (CID 4134640) is 4-phenyl-1,4lambda5-oxaphosphinane 4-oxide.
What is the SMILES notation for 4-phenyl-1,4lambda5-oxaphosphinane 4-oxide?
The canonical SMILES for 4-phenyl-1,4lambda5-oxaphosphinane 4-oxide is O=P1(c2ccccc2)CCOCC1.
What is the InChIKey of 4-phenyl-1,4lambda5-oxaphosphinane 4-oxide?
The InChIKey is SVSWBELTSKUCCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13O2P/c11-13(8-6-12-7-9-13)10-4-2-1-3-5-10/h1-5H,6-9H2.
What are the key properties of 4-phenyl-1,4lambda5-oxaphosphinane 4-oxide?
4-phenyl-1,4lambda5-oxaphosphinane 4-oxide has a molecular weight of 196.19 g/mol, XLogP of 1.71, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-1,4lambda5-oxaphosphinane 4-oxide is sourced from PubChem (CID 4134640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).