(2,3-dimethylphenyl)-heptylphosphane

C15H25P — CID 150201663

IUPAC(2,3-dimethylphenyl)-heptylphosphane
SMILESCCCCCCCPc1cccc(C)c1C
InChIInChI=1S/C15H25P/c1-4-5-6-7-8-12-16-15-11-9-10-13(2)14(15)3/h9-11,16H,4-8,12H2,1-3H3
InChIKeyFPPUOCKGPVLHHK-UHFFFAOYSA-N
MW236.34 g/mol
LogP4.58
Rot. Bonds7

About (2,3-dimethylphenyl)-heptylphosphane

(2,3-dimethylphenyl)-heptylphosphane (PubChem CID 150201663) has the molecular formula C15H25P and a molecular weight of 236.34 g/mol. Its IUPAC name is (2,3-dimethylphenyl)-heptylphosphane.

Molecular Properties

Compound Name(2,3-dimethylphenyl)-heptylphosphane
PubChem CID150201663
Molecular FormulaC15H25P
Molecular Weight236.34 g/mol
Exact Mass236.17
IUPAC Name(2,3-dimethylphenyl)-heptylphosphane
SMILESCCCCCCCPc1cccc(C)c1C
InChIInChI=1S/C15H25P/c1-4-5-6-7-8-12-16-15-11-9-10-13(2)14(15)3/h9-11,16H,4-8,12H2,1-3H3
InChIKeyFPPUOCKGPVLHHK-UHFFFAOYSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 54.58
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

hexyl-(2,3,4-trimethylphenyl)phosphane
CID 90109528
hexane;1,2,3-trimethylbenzene
CID 159405289
(2,3-dimethylphenyl)-ethoxyphosphane
CID 69053238
(2-pentylphosphanylphenyl)methanamine
CID 151860169
hexadecyl(phenyl)phosphane
CID 23361411
nonyl(phenyl)phosphane
CID 69424973
tetrakis(hexane);tris(1,2-xylene)
CID 173431292
(4-methylphenyl)-octylphosphane
CID 21096786
hexyl(phenyl)phosphane;dihydrochloride
CID 175399433
azane;1-decyl-2,3-dimethylbenzene;hydrate
CID 174675361
butan-1-ol;1,2,3-trimethylbenzene
CID 174803565
(2,3-dimethylphenyl)-methoxyphosphane
CID 69050545

Frequently Asked Questions

What is the IUPAC name of (2,3-dimethylphenyl)-heptylphosphane?
The IUPAC name of (2,3-dimethylphenyl)-heptylphosphane (CID 150201663) is (2,3-dimethylphenyl)-heptylphosphane.
What is the SMILES notation for (2,3-dimethylphenyl)-heptylphosphane?
The canonical SMILES for (2,3-dimethylphenyl)-heptylphosphane is CCCCCCCPc1cccc(C)c1C.
What is the InChIKey of (2,3-dimethylphenyl)-heptylphosphane?
The InChIKey is FPPUOCKGPVLHHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25P/c1-4-5-6-7-8-12-16-15-11-9-10-13(2)14(15)3/h9-11,16H,4-8,12H2,1-3H3.
What are the key properties of (2,3-dimethylphenyl)-heptylphosphane?
(2,3-dimethylphenyl)-heptylphosphane has a molecular weight of 236.34 g/mol, XLogP of 4.58, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethylphenyl)-heptylphosphane is sourced from PubChem (CID 150201663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).