(2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone

C15H14ClO3P — CID 18514350

IUPAC(2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone
SMILESCOc1ccc(PC(=O)c2ccccc2OC)c(Cl)c1
InChIInChI=1S/C15H14ClO3P/c1-18-10-7-8-14(12(16)9-10)20-15(17)11-5-3-4-6-13(11)19-2/h3-9,20H,1-2H3
InChIKeyWOOFPGZXVXXWDI-UHFFFAOYSA-N
MW308.70 g/mol
LogP3.50
Rot. Bonds5

About (2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone

(2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone (PubChem CID 18514350) has the molecular formula C15H14ClO3P and a molecular weight of 308.70 g/mol. Its IUPAC name is (2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone.

Molecular Properties

Compound Name(2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone
PubChem CID18514350
Molecular FormulaC15H14ClO3P
Molecular Weight308.70 g/mol
Exact Mass308.04
IUPAC Name(2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone
SMILESCOc1ccc(PC(=O)c2ccccc2OC)c(Cl)c1
InChIInChI=1S/C15H14ClO3P/c1-18-10-7-8-14(12(16)9-10)20-15(17)11-5-3-4-6-13(11)19-2/h3-9,20H,1-2H3
InChIKeyWOOFPGZXVXXWDI-UHFFFAOYSA-N
XLogP3.50
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.70
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2-chloro-4-phenoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone
CID 18513550
(4-butan-2-yloxy-2-chlorophenyl)phosphanyl-(2-methoxyphenyl)methanone
CID 18514141
(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone
CID 623894
lithium;(2-chloro-4-propan-2-yloxyphenyl)phosphanyl-(2-methylphenyl)methanone;hydride
CID 173245149
(2-chlorophenyl) 2,4-dimethoxybenzoate
CID 2366254
lithium;(2-chloro-4-propoxyphenyl)phosphanyl-(2-methylphenyl)methanone;hydride
CID 173244490
(2,6-dichloro-4-methoxyphenyl)-(2-ethoxyphenyl)phosphanylmethanone
CID 18514642
(2-fluoro-4-methoxyphenyl)-(2-methoxyphenyl)methanone
CID 43561172
(2-bromo-5-methoxyphenyl)-(2-methoxyphenyl)methanone
CID 105079993
[2-(2,5-dimethoxyphenyl)-2-oxoethyl] 2-chlorobenzoate
CID 2096696
2-chloro-N-(2,4-dimethoxyphenyl)benzamide
CID 722324
2-methoxybenzoyl iodide
CID 139677083

Frequently Asked Questions

What is the IUPAC name of (2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone?
The IUPAC name of (2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone (CID 18514350) is (2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone.
What is the SMILES notation for (2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone?
The canonical SMILES for (2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone is COc1ccc(PC(=O)c2ccccc2OC)c(Cl)c1.
What is the InChIKey of (2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone?
The InChIKey is WOOFPGZXVXXWDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClO3P/c1-18-10-7-8-14(12(16)9-10)20-15(17)11-5-3-4-6-13(11)19-2/h3-9,20H,1-2H3.
What are the key properties of (2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone?
(2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone has a molecular weight of 308.70 g/mol, XLogP of 3.50, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-4-methoxyphenyl)phosphanyl-(2-methoxyphenyl)methanone is sourced from PubChem (CID 18514350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).