1-[bis(2-methylpropyl)phosphanyl]ethanol

C10H23OP — CID 89485291

IUPAC1-[bis(2-methylpropyl)phosphanyl]ethanol
SMILESCC(C)CP(CC(C)C)C(C)O
InChIInChI=1S/C10H23OP/c1-8(2)6-12(10(5)11)7-9(3)4/h8-11H,6-7H2,1-5H3
InChIKeyBBMJRKMMMTYYFQ-UHFFFAOYSA-N
MW190.27 g/mol
LogP3.12
Rot. Bonds5

About 1-[bis(2-methylpropyl)phosphanyl]ethanol

1-[bis(2-methylpropyl)phosphanyl]ethanol (PubChem CID 89485291) has the molecular formula C10H23OP and a molecular weight of 190.27 g/mol. Its IUPAC name is 1-[bis(2-methylpropyl)phosphanyl]ethanol.

Molecular Properties

Compound Name1-[bis(2-methylpropyl)phosphanyl]ethanol
PubChem CID89485291
Molecular FormulaC10H23OP
Molecular Weight190.27 g/mol
Exact Mass190.15
IUPAC Name1-[bis(2-methylpropyl)phosphanyl]ethanol
SMILESCC(C)CP(CC(C)C)C(C)O
InChIInChI=1S/C10H23OP/c1-8(2)6-12(10(5)11)7-9(3)4/h8-11H,6-7H2,1-5H3
InChIKeyBBMJRKMMMTYYFQ-UHFFFAOYSA-N
XLogP3.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[bis(2-methylpropyl)phosphanyl]ethanol?
The IUPAC name of 1-[bis(2-methylpropyl)phosphanyl]ethanol (CID 89485291) is 1-[bis(2-methylpropyl)phosphanyl]ethanol.
What is the SMILES notation for 1-[bis(2-methylpropyl)phosphanyl]ethanol?
The canonical SMILES for 1-[bis(2-methylpropyl)phosphanyl]ethanol is CC(C)CP(CC(C)C)C(C)O.
What is the InChIKey of 1-[bis(2-methylpropyl)phosphanyl]ethanol?
The InChIKey is BBMJRKMMMTYYFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23OP/c1-8(2)6-12(10(5)11)7-9(3)4/h8-11H,6-7H2,1-5H3.
What are the key properties of 1-[bis(2-methylpropyl)phosphanyl]ethanol?
1-[bis(2-methylpropyl)phosphanyl]ethanol has a molecular weight of 190.27 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[bis(2-methylpropyl)phosphanyl]ethanol is sourced from PubChem (CID 89485291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).