(2,3-diethylphenyl)-phenoxyphosphane

C16H19OP — CID 69050696

IUPAC(2,3-diethylphenyl)-phenoxyphosphane
SMILESCCc1cccc(POc2ccccc2)c1CC
InChIInChI=1S/C16H19OP/c1-3-13-9-8-12-16(15(13)4-2)18-17-14-10-6-5-7-11-14/h5-12,18H,3-4H2,1-2H3
InChIKeyHSBYKMCMDBYFID-UHFFFAOYSA-N
MW258.30 g/mol
LogP4.11
Rot. Bonds5

About (2,3-diethylphenyl)-phenoxyphosphane

(2,3-diethylphenyl)-phenoxyphosphane (PubChem CID 69050696) has the molecular formula C16H19OP and a molecular weight of 258.30 g/mol. Its IUPAC name is (2,3-diethylphenyl)-phenoxyphosphane.

Molecular Properties

Compound Name(2,3-diethylphenyl)-phenoxyphosphane
PubChem CID69050696
Molecular FormulaC16H19OP
Molecular Weight258.30 g/mol
Exact Mass258.12
IUPAC Name(2,3-diethylphenyl)-phenoxyphosphane
SMILESCCc1cccc(POc2ccccc2)c1CC
InChIInChI=1S/C16H19OP/c1-3-13-9-8-12-16(15(13)4-2)18-17-14-10-6-5-7-11-14/h5-12,18H,3-4H2,1-2H3
InChIKeyHSBYKMCMDBYFID-UHFFFAOYSA-N
XLogP4.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

phenyl 2,3-diethylbenzenesulfonate
CID 154521454
3-ethyl-2-(phenoxymethyl)phenol
CID 174805070
(2-ethylphenyl)-[2-(2-ethylphenyl)phosphanylphenyl]phosphane
CID 87896013
1,3-diethyl-2-(2-phenylethyl)benzene
CID 14325369
(2,3-diethylphenyl)-diphenylsulfanium
CID 22057527
1-ethyl-2-octyl-3-phenoxybenzene
CID 141216641
4-[(2,3-diethylphenyl)phosphanylmethyl]benzenesulfonyl chloride;hydrobromide
CID 175403452
CID 151898438
CID 151898438
(2-ethylphenyl)-[(2-ethylphenyl)phosphanylmethyl]phosphane
CID 174976711
3-ethyl-2-phenoxyphenol
CID 66865882
1,2-diethylbenzene;hydrobromide
CID 174973685
carbamic acid;2,3-diethylphenol;methanamine
CID 174684713

Frequently Asked Questions

What is the IUPAC name of (2,3-diethylphenyl)-phenoxyphosphane?
The IUPAC name of (2,3-diethylphenyl)-phenoxyphosphane (CID 69050696) is (2,3-diethylphenyl)-phenoxyphosphane.
What is the SMILES notation for (2,3-diethylphenyl)-phenoxyphosphane?
The canonical SMILES for (2,3-diethylphenyl)-phenoxyphosphane is CCc1cccc(POc2ccccc2)c1CC.
What is the InChIKey of (2,3-diethylphenyl)-phenoxyphosphane?
The InChIKey is HSBYKMCMDBYFID-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19OP/c1-3-13-9-8-12-16(15(13)4-2)18-17-14-10-6-5-7-11-14/h5-12,18H,3-4H2,1-2H3.
What are the key properties of (2,3-diethylphenyl)-phenoxyphosphane?
(2,3-diethylphenyl)-phenoxyphosphane has a molecular weight of 258.30 g/mol, XLogP of 4.11, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-diethylphenyl)-phenoxyphosphane is sourced from PubChem (CID 69050696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).