[butyl(hydroxy)phosphoryl]azanide

C4H11NO2P- — CID 163826899

IUPAC[butyl(hydroxy)phosphoryl]azanide
SMILESCCCCP([NH-])(=O)O
InChIInChI=1S/C4H11NO2P/c1-2-3-4-8(5,6)7/h2-4H2,1H3,(H2-,5,6,7)/q-1
InChIKeyOAGFXZZLQPHQQG-UHFFFAOYSA-N
MW136.11 g/mol
LogP2.02
Rot. Bonds3

About [butyl(hydroxy)phosphoryl]azanide

[butyl(hydroxy)phosphoryl]azanide (PubChem CID 163826899) has the molecular formula C4H11NO2P- and a molecular weight of 136.11 g/mol. Its IUPAC name is [butyl(hydroxy)phosphoryl]azanide.

Molecular Properties

Compound Name[butyl(hydroxy)phosphoryl]azanide
PubChem CID163826899
Molecular FormulaC4H11NO2P-
Molecular Weight136.11 g/mol
Exact Mass136.05
IUPAC Name[butyl(hydroxy)phosphoryl]azanide
SMILESCCCCP([NH-])(=O)O
InChIInChI=1S/C4H11NO2P/c1-2-3-4-8(5,6)7/h2-4H2,1H3,(H2-,5,6,7)/q-1
InChIKeyOAGFXZZLQPHQQG-UHFFFAOYSA-N
XLogP2.02
TPSA61.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.11
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

butylphosphonic acid;neodymium
CID 134499527
butyl(methyl)phosphinic acid
CID 10909622
dibutylphosphorylmethanol
CID 5219006
[butyl(hydroxy)phosphoryl]phosphonic acid
CID 23219870
potassium;butylphosphonic acid;hydride
CID 174388690
alumane;butyl(propyl)phosphinic acid
CID 174987333
dodecane;phosphoric acid
CID 88801558
butyl(2-hydroxyethyl)phosphinic acid
CID 87233440
CID 172720905
CID 172720905
azane;pentylphosphonic acid
CID 173073704
hexylphosphonic acid;octylphosphonic acid
CID 155346901
didecylphosphinic acid;nickel
CID 87135973

Frequently Asked Questions

What is the IUPAC name of [butyl(hydroxy)phosphoryl]azanide?
The IUPAC name of [butyl(hydroxy)phosphoryl]azanide (CID 163826899) is [butyl(hydroxy)phosphoryl]azanide.
What is the SMILES notation for [butyl(hydroxy)phosphoryl]azanide?
The canonical SMILES for [butyl(hydroxy)phosphoryl]azanide is CCCCP([NH-])(=O)O.
What is the InChIKey of [butyl(hydroxy)phosphoryl]azanide?
The InChIKey is OAGFXZZLQPHQQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO2P/c1-2-3-4-8(5,6)7/h2-4H2,1H3,(H2-,5,6,7)/q-1.
What are the key properties of [butyl(hydroxy)phosphoryl]azanide?
[butyl(hydroxy)phosphoryl]azanide has a molecular weight of 136.11 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [butyl(hydroxy)phosphoryl]azanide is sourced from PubChem (CID 163826899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).