O-[methyl(octoxy)phosphoryl]hydroxylamine

C9H22NO3P — CID 87877912

IUPACO-[methyl(octoxy)phosphoryl]hydroxylamine
SMILESCCCCCCCCOP(C)(=O)ON
InChIInChI=1S/C9H22NO3P/c1-3-4-5-6-7-8-9-12-14(2,11)13-10/h3-10H2,1-2H3
InChIKeyKWMVJMUXLREFFC-UHFFFAOYSA-N
MW223.25 g/mol
LogP3.08
Rot. Bonds9

About O-[methyl(octoxy)phosphoryl]hydroxylamine

O-[methyl(octoxy)phosphoryl]hydroxylamine (PubChem CID 87877912) has the molecular formula C9H22NO3P and a molecular weight of 223.25 g/mol. Its IUPAC name is O-[methyl(octoxy)phosphoryl]hydroxylamine.

Molecular Properties

Compound NameO-[methyl(octoxy)phosphoryl]hydroxylamine
PubChem CID87877912
Molecular FormulaC9H22NO3P
Molecular Weight223.25 g/mol
Exact Mass223.13
IUPAC NameO-[methyl(octoxy)phosphoryl]hydroxylamine
SMILESCCCCCCCCOP(C)(=O)ON
InChIInChI=1S/C9H22NO3P/c1-3-4-5-6-7-8-9-12-14(2,11)13-10/h3-10H2,1-2H3
InChIKeyKWMVJMUXLREFFC-UHFFFAOYSA-N
XLogP3.08
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

1-[methyl(octoxy)phosphoryl]oxyoctane
CID 15779
1-[butoxy(methyl)phosphoryl]oxydecane
CID 89088308
amino hexyl hydrogen phosphate
CID 57238608
dodecyl dioctyl phosphate
CID 57134013
diheptyl hexyl phosphate
CID 175578950
1-[chloro(methyl)phosphoryl]oxyheptane
CID 13173235
1-[fluoro(propoxy)phosphoryl]oxyhexane
CID 172772992
butyl dihexyl phosphate
CID 22497695
diheptyl propyl phosphate
CID 22497721
alumane;trioctyl phosphate
CID 175071420
potassium tris-decyl phosphate
CID 21118666
dibutyl decyl phosphate
CID 19784867

Frequently Asked Questions

What is the IUPAC name of O-[methyl(octoxy)phosphoryl]hydroxylamine?
The IUPAC name of O-[methyl(octoxy)phosphoryl]hydroxylamine (CID 87877912) is O-[methyl(octoxy)phosphoryl]hydroxylamine.
What is the SMILES notation for O-[methyl(octoxy)phosphoryl]hydroxylamine?
The canonical SMILES for O-[methyl(octoxy)phosphoryl]hydroxylamine is CCCCCCCCOP(C)(=O)ON.
What is the InChIKey of O-[methyl(octoxy)phosphoryl]hydroxylamine?
The InChIKey is KWMVJMUXLREFFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22NO3P/c1-3-4-5-6-7-8-9-12-14(2,11)13-10/h3-10H2,1-2H3.
What are the key properties of O-[methyl(octoxy)phosphoryl]hydroxylamine?
O-[methyl(octoxy)phosphoryl]hydroxylamine has a molecular weight of 223.25 g/mol, XLogP of 3.08, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-[methyl(octoxy)phosphoryl]hydroxylamine is sourced from PubChem (CID 87877912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).