[amino(methyl)phosphoryl]oxybenzene

C7H10NO2P — CID 11864135

IUPAC[amino(methyl)phosphoryl]oxybenzene
SMILESC[P@](N)(=O)Oc1ccccc1
InChIInChI=1S/C7H10NO2P/c1-11(8,9)10-7-5-3-2-4-6-7/h2-6H,1H3,(H2,8,9)/t11-/m0/s1
InChIKeyYLLKXESRELMTNK-NSHDSACASA-N
MW171.14 g/mol
LogP1.85
Rot. Bonds2

About [amino(methyl)phosphoryl]oxybenzene

[amino(methyl)phosphoryl]oxybenzene (PubChem CID 11864135) has the molecular formula C7H10NO2P and a molecular weight of 171.14 g/mol. Its IUPAC name is [amino(methyl)phosphoryl]oxybenzene.

Molecular Properties

Compound Name[amino(methyl)phosphoryl]oxybenzene
PubChem CID11864135
Molecular FormulaC7H10NO2P
Molecular Weight171.14 g/mol
Exact Mass171.04
IUPAC Name[amino(methyl)phosphoryl]oxybenzene
SMILESC[P@](N)(=O)Oc1ccccc1
InChIInChI=1S/C7H10NO2P/c1-11(8,9)10-7-5-3-2-4-6-7/h2-6H,1H3,(H2,8,9)/t11-/m0/s1
InChIKeyYLLKXESRELMTNK-NSHDSACASA-N
XLogP1.85
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.14
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

cobalt(2+);methyl(phenoxy)phosphinate
CID 140813109
[methyl-[[methyl(phenoxy)phosphoryl]amino]phosphoryl]oxybenzene
CID 11865181
[methoxy(methyl)phosphoryl]oxybenzene
CID 564592
N-methyl-N-[methyl(phenoxy)phosphoryl]methanamine
CID 102289080
dimethyl phenyl phosphate;ethane;trimethyl phosphate
CID 90867053
bis(4-diphenoxyphosphoryloxyphenyl) phenyl phosphate
CID 58066863
triphenyl phosphate;hydrate
CID 66881958
2-methylpropane;triphenyl phosphate
CID 91193965
[chloromethyl(methyl)phosphoryl]oxybenzene
CID 71410923
1,3-bis[[methyl(phenoxy)phosphoryl]oxy]benzene;ethane
CID 160703248
tetrasodium phenyl phosphate
CID 172856118
disodium;phenyl phosphate
CID 2724225

Frequently Asked Questions

What is the IUPAC name of [amino(methyl)phosphoryl]oxybenzene?
The IUPAC name of [amino(methyl)phosphoryl]oxybenzene (CID 11864135) is [amino(methyl)phosphoryl]oxybenzene.
What is the SMILES notation for [amino(methyl)phosphoryl]oxybenzene?
The canonical SMILES for [amino(methyl)phosphoryl]oxybenzene is C[P@](N)(=O)Oc1ccccc1.
What is the InChIKey of [amino(methyl)phosphoryl]oxybenzene?
The InChIKey is YLLKXESRELMTNK-NSHDSACASA-N. The full InChI is InChI=1S/C7H10NO2P/c1-11(8,9)10-7-5-3-2-4-6-7/h2-6H,1H3,(H2,8,9)/t11-/m0/s1.
What are the key properties of [amino(methyl)phosphoryl]oxybenzene?
[amino(methyl)phosphoryl]oxybenzene has a molecular weight of 171.14 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [amino(methyl)phosphoryl]oxybenzene is sourced from PubChem (CID 11864135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).