decyl(2-phenylethyl)phosphane

C18H31P — CID 69425804

IUPACdecyl(2-phenylethyl)phosphane
SMILESCCCCCCCCCCPCCc1ccccc1
InChIInChI=1S/C18H31P/c1-2-3-4-5-6-7-8-12-16-19-17-15-18-13-10-9-11-14-18/h9-11,13-14,19H,2-8,12,15-17H2,1H3
InChIKeyHSUZDSUPWKKVEY-UHFFFAOYSA-N
MW278.42 g/mol
LogP6.05
Rot. Bonds12

About decyl(2-phenylethyl)phosphane

decyl(2-phenylethyl)phosphane (PubChem CID 69425804) has the molecular formula C18H31P and a molecular weight of 278.42 g/mol. Its IUPAC name is decyl(2-phenylethyl)phosphane.

Molecular Properties

Compound Namedecyl(2-phenylethyl)phosphane
PubChem CID69425804
Molecular FormulaC18H31P
Molecular Weight278.42 g/mol
Exact Mass278.22
IUPAC Namedecyl(2-phenylethyl)phosphane
SMILESCCCCCCCCCCPCCc1ccccc1
InChIInChI=1S/C18H31P/c1-2-3-4-5-6-7-8-12-16-19-17-15-18-13-10-9-11-14-18/h9-11,13-14,19H,2-8,12,15-17H2,1H3
InChIKeyHSUZDSUPWKKVEY-UHFFFAOYSA-N
XLogP6.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.42
LogP ≤ 56.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

butyl(2-phenylethyl)phosphane
CID 69425229
benzyl(pentadecyl)phosphane
CID 174798233
benzyl(pentadecyl)phosphane;hydrobromide
CID 174798232
octylbenzene
CID 16607
octacosylbenzene
CID 14228596
pentadecane;pentadecylbenzene
CID 174970881
octaoctacontylbenzene
CID 165359374
pentanonacontylbenzene
CID 165359347
hexylbenzene;hydrogen peroxide
CID 90001206
CID 67791041
CID 67791041
dodecylbenzene;sulfane
CID 20560423
azane;tetradecylbenzene
CID 70503489

Frequently Asked Questions

What is the IUPAC name of decyl(2-phenylethyl)phosphane?
The IUPAC name of decyl(2-phenylethyl)phosphane (CID 69425804) is decyl(2-phenylethyl)phosphane.
What is the SMILES notation for decyl(2-phenylethyl)phosphane?
The canonical SMILES for decyl(2-phenylethyl)phosphane is CCCCCCCCCCPCCc1ccccc1.
What is the InChIKey of decyl(2-phenylethyl)phosphane?
The InChIKey is HSUZDSUPWKKVEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31P/c1-2-3-4-5-6-7-8-12-16-19-17-15-18-13-10-9-11-14-18/h9-11,13-14,19H,2-8,12,15-17H2,1H3.
What are the key properties of decyl(2-phenylethyl)phosphane?
decyl(2-phenylethyl)phosphane has a molecular weight of 278.42 g/mol, XLogP of 6.05, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for decyl(2-phenylethyl)phosphane is sourced from PubChem (CID 69425804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).