chlorophosphane;1-pentoxypentane

C10H24ClOP — CID 175245109

IUPACchlorophosphane;1-pentoxypentane
SMILESCCCCCOCCCCC.PCl
InChIInChI=1S/C10H22O.ClH2P/c1-3-5-7-9-11-10-8-6-4-2;1-2/h3-10H2,1-2H3;2H2
InChIKeyYGILONCBTMJMFE-UHFFFAOYSA-N
MW226.73 g/mol
LogP4.40
Rot. Bonds8

About chlorophosphane;1-pentoxypentane

chlorophosphane;1-pentoxypentane (PubChem CID 175245109) has the molecular formula C10H24ClOP and a molecular weight of 226.73 g/mol. Its IUPAC name is chlorophosphane;1-pentoxypentane.

Molecular Properties

Compound Namechlorophosphane;1-pentoxypentane
PubChem CID175245109
Molecular FormulaC10H24ClOP
Molecular Weight226.73 g/mol
Exact Mass226.13
IUPAC Namechlorophosphane;1-pentoxypentane
SMILESCCCCCOCCCCC.PCl
InChIInChI=1S/C10H22O.ClH2P/c1-3-5-7-9-11-10-8-6-4-2;1-2/h3-10H2,1-2H3;2H2
InChIKeyYGILONCBTMJMFE-UHFFFAOYSA-N
XLogP4.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.73
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

1-dodecoxyhexadecane
CID 22256973
1-decoxydocosane
CID 87077677
1-heptoxydocosane
CID 91692957
1-(6-pentadecoxyhexoxy)pentadecane
CID 139884766
1-heptacosoxyheptacosane
CID 57287180
1-(6-octadecoxyhexoxy)octadecane
CID 139884769
1-(7-tetradecoxyheptoxy)tetradecane
CID 139884729
1-hexacosoxyhexacosane
CID 56611156
1-(2-decoxyethoxy)decane
CID 14009354
1-hexoxyhexane;yttrium
CID 87066735
methane;1-pentoxypentane;hydrate
CID 175598954
1-[2-[2-[2-[2-(2-pentoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]heptane
CID 150797704

Frequently Asked Questions

What is the IUPAC name of chlorophosphane;1-pentoxypentane?
The IUPAC name of chlorophosphane;1-pentoxypentane (CID 175245109) is chlorophosphane;1-pentoxypentane.
What is the SMILES notation for chlorophosphane;1-pentoxypentane?
The canonical SMILES for chlorophosphane;1-pentoxypentane is CCCCCOCCCCC.PCl.
What is the InChIKey of chlorophosphane;1-pentoxypentane?
The InChIKey is YGILONCBTMJMFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O.ClH2P/c1-3-5-7-9-11-10-8-6-4-2;1-2/h3-10H2,1-2H3;2H2.
What are the key properties of chlorophosphane;1-pentoxypentane?
chlorophosphane;1-pentoxypentane has a molecular weight of 226.73 g/mol, XLogP of 4.40, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chlorophosphane;1-pentoxypentane is sourced from PubChem (CID 175245109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).