dibutyl-dihydroxy-phenoxy-λ5-phosphane

C14H25O3P — CID 141047661

IUPACdibutyl-dihydroxy-phenoxy-λ5-phosphane
SMILESCCCCP(O)(O)(CCCC)Oc1ccccc1
InChIInChI=1S/C14H25O3P/c1-3-5-12-18(15,16,13-6-4-2)17-14-10-8-7-9-11-14/h7-11,15-16H,3-6,12-13H2,1-2H3
InChIKeyCGPQPVPEEIZJKV-UHFFFAOYSA-N
MW272.32 g/mol
LogP3.95
Rot. Bonds8

About dibutyl-dihydroxy-phenoxy-λ5-phosphane

dibutyl-dihydroxy-phenoxy-λ5-phosphane (PubChem CID 141047661) has the molecular formula C14H25O3P and a molecular weight of 272.32 g/mol. Its IUPAC name is dibutyl-dihydroxy-phenoxy-λ5-phosphane.

Molecular Properties

Compound Namedibutyl-dihydroxy-phenoxy-λ5-phosphane
PubChem CID141047661
Molecular FormulaC14H25O3P
Molecular Weight272.32 g/mol
Exact Mass272.15
IUPAC Namedibutyl-dihydroxy-phenoxy-λ5-phosphane
SMILESCCCCP(O)(O)(CCCC)Oc1ccccc1
InChIInChI=1S/C14H25O3P/c1-3-5-12-18(15,16,13-6-4-2)17-14-10-8-7-9-11-14/h7-11,15-16H,3-6,12-13H2,1-2H3
InChIKeyCGPQPVPEEIZJKV-UHFFFAOYSA-N
XLogP3.95
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze dibutyl-dihydroxy-phenoxy-λ5-phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

dihydroxy-phenoxy-di(tetradecyl)-λ5-phosphane
CID 175519333
2-phenoxyethanol;tetradecan-1-ol
CID 118450850
phenoxybenzene;tetradecanoic acid
CID 175422794
acetic acid;butoxybenzene
CID 162338086
dodecyl-trihydroxy-phenyl-λ5-phosphane
CID 57297233
undecan-6-yloxybenzene
CID 130316504
pentoxybenzene;undecane
CID 174778179
bis(decane);phenoxyphosphane
CID 91140487
methyl(tetraphenoxy)-lambda5-phosphane
CID 14294612
tetracosan-8-yloxybenzene
CID 154135377
(1R)-1-phenoxypentane-1-thiol
CID 134536551
dibutyl(3-phenoxypropyl)azanium
CID 140631674

Frequently Asked Questions

What is the IUPAC name of dibutyl-dihydroxy-phenoxy-λ5-phosphane?
The IUPAC name of dibutyl-dihydroxy-phenoxy-λ5-phosphane (CID 141047661) is dibutyl-dihydroxy-phenoxy-λ5-phosphane.
What is the SMILES notation for dibutyl-dihydroxy-phenoxy-λ5-phosphane?
The canonical SMILES for dibutyl-dihydroxy-phenoxy-λ5-phosphane is CCCCP(O)(O)(CCCC)Oc1ccccc1.
What is the InChIKey of dibutyl-dihydroxy-phenoxy-λ5-phosphane?
The InChIKey is CGPQPVPEEIZJKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25O3P/c1-3-5-12-18(15,16,13-6-4-2)17-14-10-8-7-9-11-14/h7-11,15-16H,3-6,12-13H2,1-2H3.
What are the key properties of dibutyl-dihydroxy-phenoxy-λ5-phosphane?
dibutyl-dihydroxy-phenoxy-λ5-phosphane has a molecular weight of 272.32 g/mol, XLogP of 3.95, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-dihydroxy-phenoxy-λ5-phosphane is sourced from PubChem (CID 141047661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).