2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene

C20H25O4P — CID 66742321

IUPAC2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene
SMILESC=Cc1cc(P(=O)(OCC)c2ccc(OC)cc2)ccc1OC(C)C
InChIInChI=1S/C20H25O4P/c1-6-16-14-19(12-13-20(16)24-15(3)4)25(21,23-7-2)18-10-8-17(22-5)9-11-18/h6,8-15H,1,7H2,2-5H3
InChIKeyDBYPMJRWLMOREA-UHFFFAOYSA-N
MW360.39 g/mol
LogP4.39
Rot. Bonds8

About 2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene

2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene (PubChem CID 66742321) has the molecular formula C20H25O4P and a molecular weight of 360.39 g/mol. Its IUPAC name is 2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene.

Molecular Properties

Compound Name2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene
PubChem CID66742321
Molecular FormulaC20H25O4P
Molecular Weight360.39 g/mol
Exact Mass360.15
IUPAC Name2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene
SMILESC=Cc1cc(P(=O)(OCC)c2ccc(OC)cc2)ccc1OC(C)C
InChIInChI=1S/C20H25O4P/c1-6-16-14-19(12-13-20(16)24-15(3)4)25(21,23-7-2)18-10-8-17(22-5)9-11-18/h6,8-15H,1,7H2,2-5H3
InChIKeyDBYPMJRWLMOREA-UHFFFAOYSA-N
XLogP4.39
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dichloro-[[5-[ethoxy(phenyl)phosphoryl]-2-propan-2-yloxyphenyl]methylidene]ruthenium
CID 59154106
2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene
CID 102247848
2-ethenyl-4-[[2-[(3-ethenyl-4-propan-2-yloxyphenoxy)methyl]phenyl]methoxy]-1-propan-2-yloxybenzene
CID 101431014
2-ethenyl-4-fluoro-1-propan-2-yloxybenzene
CID 25197210
N-[(4-methoxyphenyl)-prop-2-enoxyphosphoryl]prop-2-en-1-amine
CID 91613836
4-methoxy-2-propan-2-yloxybenzenesulfonamide
CID 69224497
diethyl 2-[[2,5-di(propan-2-yloxy)phenyl]methylidene]propanedioate
CID 70577906
1-ethenyl-3-ethoxy-4-methoxy-2-propan-2-yloxybenzene
CID 21125479
2-ethenyl-3-propan-2-yloxynaphthalene;2-propan-2-yloxynaphthalene
CID 173224247
(3-ethenyl-4-propan-2-yloxyphenyl)methyl-dimethyl-[2-(trimethylazaniumyl)ethyl]azanium
CID 102326558
dichloro-[(5-methoxy-2-propan-2-yloxyphenyl)methylidene]ruthenium
CID 153434955
1-chloro-4-[(4-chlorophenyl)-ethoxyphosphoryl]benzene
CID 23280250

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene?
The IUPAC name of 2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene (CID 66742321) is 2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene.
What is the SMILES notation for 2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene?
The canonical SMILES for 2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene is C=Cc1cc(P(=O)(OCC)c2ccc(OC)cc2)ccc1OC(C)C.
What is the InChIKey of 2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene?
The InChIKey is DBYPMJRWLMOREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25O4P/c1-6-16-14-19(12-13-20(16)24-15(3)4)25(21,23-7-2)18-10-8-17(22-5)9-11-18/h6,8-15H,1,7H2,2-5H3.
What are the key properties of 2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene?
2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene has a molecular weight of 360.39 g/mol, XLogP of 4.39, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-4-[ethoxy-(4-methoxyphenyl)phosphoryl]-1-propan-2-yloxybenzene is sourced from PubChem (CID 66742321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).