[1-adamantyloxy(chloro)phosphoryl] hypochlorite

C10H15Cl2O3P — CID 174641384

IUPAC[1-adamantyloxy(chloro)phosphoryl] hypochlorite
SMILESO=P(Cl)(OCl)OC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C10H15Cl2O3P/c11-15-16(12,13)14-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2
InChIKeyIPZMSSWHMFEHKP-UHFFFAOYSA-N
MW285.11 g/mol
LogP4.49
Rot. Bonds3

About [1-adamantyloxy(chloro)phosphoryl] hypochlorite

[1-adamantyloxy(chloro)phosphoryl] hypochlorite (PubChem CID 174641384) has the molecular formula C10H15Cl2O3P and a molecular weight of 285.11 g/mol. Its IUPAC name is [1-adamantyloxy(chloro)phosphoryl] hypochlorite.

Molecular Properties

Compound Name[1-adamantyloxy(chloro)phosphoryl] hypochlorite
PubChem CID174641384
Molecular FormulaC10H15Cl2O3P
Molecular Weight285.11 g/mol
Exact Mass284.01
IUPAC Name[1-adamantyloxy(chloro)phosphoryl] hypochlorite
SMILESO=P(Cl)(OCl)OC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C10H15Cl2O3P/c11-15-16(12,13)14-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2
InChIKeyIPZMSSWHMFEHKP-UHFFFAOYSA-N
XLogP4.49
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.11
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [1-adamantyloxy(chloro)phosphoryl] hypochlorite with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-adamantyloxy(oxido)phosphoryl]formate
CID 91929075
1-adamantyl dihydrogen phosphate;oxetane
CID 66838482
1-[ethenyl(methoxy)phosphoryl]oxyadamantane
CID 172839250
sodium 1-adamantyloxy(methoxycarbonyl)phosphinate
CID 23699004
1-methoxyadamantane
CID 584854
1-adamantyl amino carbonate
CID 69008372
N-[1-adamantyloxy(phenoxy)phosphoryl]methanamine
CID 11904215
N-(1-adamantyloxy)acetamide
CID 87737951
1-adamantyl methanimidate
CID 134861541
N-(1-adamantyloxy)formamide
CID 54075706
1-adamantyl 2,2-difluoroacetate
CID 58225853
sodium;1-adamantyl acetate;hydride
CID 174617949

Frequently Asked Questions

What is the IUPAC name of [1-adamantyloxy(chloro)phosphoryl] hypochlorite?
The IUPAC name of [1-adamantyloxy(chloro)phosphoryl] hypochlorite (CID 174641384) is [1-adamantyloxy(chloro)phosphoryl] hypochlorite.
What is the SMILES notation for [1-adamantyloxy(chloro)phosphoryl] hypochlorite?
The canonical SMILES for [1-adamantyloxy(chloro)phosphoryl] hypochlorite is O=P(Cl)(OCl)OC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of [1-adamantyloxy(chloro)phosphoryl] hypochlorite?
The InChIKey is IPZMSSWHMFEHKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15Cl2O3P/c11-15-16(12,13)14-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2.
What are the key properties of [1-adamantyloxy(chloro)phosphoryl] hypochlorite?
[1-adamantyloxy(chloro)phosphoryl] hypochlorite has a molecular weight of 285.11 g/mol, XLogP of 4.49, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-adamantyloxy(chloro)phosphoryl] hypochlorite is sourced from PubChem (CID 174641384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).