(2,5-dimethoxyphenyl)-hydroxy-oxophosphanium

C8H10O4P+ — CID 135080544

IUPAC(2,5-dimethoxyphenyl)-hydroxy-oxophosphanium
SMILESCOc1ccc(OC)c([P+](=O)O)c1
InChIInChI=1S/C8H9O4P/c1-11-6-3-4-7(12-2)8(5-6)13(9)10/h3-5H,1-2H3/p+1
InChIKeyDKXRPSVJYFFJQZ-UHFFFAOYSA-O
MW201.14 g/mol
LogP1.06
Rot. Bonds3

About (2,5-dimethoxyphenyl)-hydroxy-oxophosphanium

(2,5-dimethoxyphenyl)-hydroxy-oxophosphanium (PubChem CID 135080544) has the molecular formula C8H10O4P+ and a molecular weight of 201.14 g/mol. Its IUPAC name is (2,5-dimethoxyphenyl)-hydroxy-oxophosphanium.

Molecular Properties

Compound Name(2,5-dimethoxyphenyl)-hydroxy-oxophosphanium
PubChem CID135080544
Molecular FormulaC8H10O4P+
Molecular Weight201.14 g/mol
Exact Mass201.03
IUPAC Name(2,5-dimethoxyphenyl)-hydroxy-oxophosphanium
SMILESCOc1ccc(OC)c([P+](=O)O)c1
InChIInChI=1S/C8H9O4P/c1-11-6-3-4-7(12-2)8(5-6)13(9)10/h3-5H,1-2H3/p+1
InChIKeyDKXRPSVJYFFJQZ-UHFFFAOYSA-O
XLogP1.06
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.14
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2,4-dimethoxyphenyl)-methoxy-oxophosphanium
CID 70627642
(2,5-dimethoxybenzoyl) 2,5-dimethoxybenzoate
CID 122207257
4-(2,4-dimethoxyphenoxy)benzaldehyde
CID 118874779
3-(2,5-dimethoxyphenyl)pentane-2,4-dione
CID 98661157
1,4-dimethoxy-2-(3-methoxyphenoxy)benzene
CID 95561214
1,2-dimethoxy-4-(5-methoxy-2-methylphenoxy)benzene
CID 123959246
(2,4-dimethoxyphenyl) formate
CID 11137749
2,4-dimethoxybenzoic acid
CID 7052
2,4-dimethoxybenzoic acid
CID 67450326
O-(2,5-dimethoxyphenyl)hydroxylamine
CID 117273124
2-[4-(2,5-dimethoxyphenyl)phenyl]-1,4-dimethoxybenzene
CID 172792841
2-hydroxyethyl 2,5-dimethoxybenzoate
CID 116862870

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethoxyphenyl)-hydroxy-oxophosphanium?
The IUPAC name of (2,5-dimethoxyphenyl)-hydroxy-oxophosphanium (CID 135080544) is (2,5-dimethoxyphenyl)-hydroxy-oxophosphanium.
What is the SMILES notation for (2,5-dimethoxyphenyl)-hydroxy-oxophosphanium?
The canonical SMILES for (2,5-dimethoxyphenyl)-hydroxy-oxophosphanium is COc1ccc(OC)c([P+](=O)O)c1.
What is the InChIKey of (2,5-dimethoxyphenyl)-hydroxy-oxophosphanium?
The InChIKey is DKXRPSVJYFFJQZ-UHFFFAOYSA-O. The full InChI is InChI=1S/C8H9O4P/c1-11-6-3-4-7(12-2)8(5-6)13(9)10/h3-5H,1-2H3/p+1.
What are the key properties of (2,5-dimethoxyphenyl)-hydroxy-oxophosphanium?
(2,5-dimethoxyphenyl)-hydroxy-oxophosphanium has a molecular weight of 201.14 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethoxyphenyl)-hydroxy-oxophosphanium is sourced from PubChem (CID 135080544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).