diphenyl(1-phenylpentan-3-yloxy)phosphane

C23H25OP — CID 86075514

IUPACdiphenyl(1-phenylpentan-3-yloxy)phosphane
SMILESCCC(CCc1ccccc1)OP(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H25OP/c1-2-21(19-18-20-12-6-3-7-13-20)24-25(22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-17,21H,2,18-19H2,1H3
InChIKeyQANNKKPNSWQFPD-UHFFFAOYSA-N
MW348.43 g/mol
LogP5.46
Rot. Bonds8

About diphenyl(1-phenylpentan-3-yloxy)phosphane

diphenyl(1-phenylpentan-3-yloxy)phosphane (PubChem CID 86075514) has the molecular formula C23H25OP and a molecular weight of 348.43 g/mol. Its IUPAC name is diphenyl(1-phenylpentan-3-yloxy)phosphane.

Molecular Properties

Compound Namediphenyl(1-phenylpentan-3-yloxy)phosphane
PubChem CID86075514
Molecular FormulaC23H25OP
Molecular Weight348.43 g/mol
Exact Mass348.16
IUPAC Namediphenyl(1-phenylpentan-3-yloxy)phosphane
SMILESCCC(CCc1ccccc1)OP(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H25OP/c1-2-21(19-18-20-12-6-3-7-13-20)24-25(22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-17,21H,2,18-19H2,1H3
InChIKeyQANNKKPNSWQFPD-UHFFFAOYSA-N
XLogP5.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.43
LogP ≤ 55.46
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

1-phenylpentan-3-yl formate
CID 58248129
diphenyl(1-phenylpropan-2-yloxy)phosphane
CID 86075511
3,4-dimethylhexylbenzene
CID 72602417
1-phenylhexan-3-yl hydrogen carbonate
CID 67178978
3,5-diethoxypentylbenzene
CID 156769250
N,N,4-trimethyl-1-phenylhexan-3-amine
CID 54141645
(3R)-3-phenylmethoxypentan-1-ol
CID 130841649
3-ethylundecylbenzene
CID 101046196
1-phenylheptan-3-yl hydrogen carbonate
CID 67177512
N-methyl-3-(2-phenylethoxy)pentan-1-amine
CID 142009741
hexan-3-yloxymethylbenzene
CID 20782034
trifluoro-[(3S)-1-phenylpentan-3-yl]boranuide
CID 102300909

Frequently Asked Questions

What is the IUPAC name of diphenyl(1-phenylpentan-3-yloxy)phosphane?
The IUPAC name of diphenyl(1-phenylpentan-3-yloxy)phosphane (CID 86075514) is diphenyl(1-phenylpentan-3-yloxy)phosphane.
What is the SMILES notation for diphenyl(1-phenylpentan-3-yloxy)phosphane?
The canonical SMILES for diphenyl(1-phenylpentan-3-yloxy)phosphane is CCC(CCc1ccccc1)OP(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenyl(1-phenylpentan-3-yloxy)phosphane?
The InChIKey is QANNKKPNSWQFPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25OP/c1-2-21(19-18-20-12-6-3-7-13-20)24-25(22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-17,21H,2,18-19H2,1H3.
What are the key properties of diphenyl(1-phenylpentan-3-yloxy)phosphane?
diphenyl(1-phenylpentan-3-yloxy)phosphane has a molecular weight of 348.43 g/mol, XLogP of 5.46, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl(1-phenylpentan-3-yloxy)phosphane is sourced from PubChem (CID 86075514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).