butyl(cyclopentylmethoxy)phosphinic acid

C10H21O3P — CID 87155036

IUPACbutyl(cyclopentylmethoxy)phosphinic acid
SMILESCCCCP(=O)(O)OCC1CCCC1
InChIInChI=1S/C10H21O3P/c1-2-3-8-14(11,12)13-9-10-6-4-5-7-10/h10H,2-9H2,1H3,(H,11,12)
InChIKeyRAWDIHIKKKCJFF-UHFFFAOYSA-N
MW220.25 g/mol
LogP3.18
Rot. Bonds6

About butyl(cyclopentylmethoxy)phosphinic acid

butyl(cyclopentylmethoxy)phosphinic acid (PubChem CID 87155036) has the molecular formula C10H21O3P and a molecular weight of 220.25 g/mol. Its IUPAC name is butyl(cyclopentylmethoxy)phosphinic acid.

Molecular Properties

Compound Namebutyl(cyclopentylmethoxy)phosphinic acid
PubChem CID87155036
Molecular FormulaC10H21O3P
Molecular Weight220.25 g/mol
Exact Mass220.12
IUPAC Namebutyl(cyclopentylmethoxy)phosphinic acid
SMILESCCCCP(=O)(O)OCC1CCCC1
InChIInChI=1S/C10H21O3P/c1-2-3-8-14(11,12)13-9-10-6-4-5-7-10/h10H,2-9H2,1H3,(H,11,12)
InChIKeyRAWDIHIKKKCJFF-UHFFFAOYSA-N
XLogP3.18
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

butyl(2-cyclopentylethyl)phosphinic acid
CID 134348808
cyclohexylmethyl dihydrogen phosphate
CID 14982025
[fluoro(propyl)phosphoryl]oxymethylcyclohexane
CID 581368
cyclohexyloxy(dodecyl)phosphinic acid
CID 174792280
butyl(decoxy)phosphinic acid
CID 139947140
butyl(hexoxy)phosphinic acid
CID 15271220
N-amino-(cyclopentylmethoxy)phosphonamidic acid
CID 174683153
cycloheptylmethyl hexanoate
CID 54549126
2-[butyl(pentoxy)phosphoryl]oxyethylcyclohexane
CID 91716564
butane;ethoxy(hexyl)phosphinic acid
CID 174841560
decoxy(decyl)phosphinic acid;iron
CID 87601920
dodecyl(nonoxy)phosphinic acid
CID 139947157

Frequently Asked Questions

What is the IUPAC name of butyl(cyclopentylmethoxy)phosphinic acid?
The IUPAC name of butyl(cyclopentylmethoxy)phosphinic acid (CID 87155036) is butyl(cyclopentylmethoxy)phosphinic acid.
What is the SMILES notation for butyl(cyclopentylmethoxy)phosphinic acid?
The canonical SMILES for butyl(cyclopentylmethoxy)phosphinic acid is CCCCP(=O)(O)OCC1CCCC1.
What is the InChIKey of butyl(cyclopentylmethoxy)phosphinic acid?
The InChIKey is RAWDIHIKKKCJFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21O3P/c1-2-3-8-14(11,12)13-9-10-6-4-5-7-10/h10H,2-9H2,1H3,(H,11,12).
What are the key properties of butyl(cyclopentylmethoxy)phosphinic acid?
butyl(cyclopentylmethoxy)phosphinic acid has a molecular weight of 220.25 g/mol, XLogP of 3.18, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butyl(cyclopentylmethoxy)phosphinic acid is sourced from PubChem (CID 87155036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).