potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene

C13H19KO2 — CID 175484509

IUPACpotassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene
SMILESC=CCc1ccc(OCCC)c(OC)c1.[H-].[K+]
InChIInChI=1S/C13H18O2.K.H/c1-4-6-11-7-8-12(15-9-5-2)13(10-11)14-3;;/h4,7-8,10H,1,5-6,9H2,2-3H3;;/q;+1;-1
InChIKeyOCQOUFHLNUAWNE-UHFFFAOYSA-N
MW246.39 g/mol
LogP0.33
Rot. Bonds6

About potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene

potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene (PubChem CID 175484509) has the molecular formula C13H19KO2 and a molecular weight of 246.39 g/mol. Its IUPAC name is potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene.

Molecular Properties

Compound Namepotassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene
PubChem CID175484509
Molecular FormulaC13H19KO2
Molecular Weight246.39 g/mol
Exact Mass246.10
IUPAC Namepotassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene
SMILESC=CCc1ccc(OCCC)c(OC)c1.[H-].[K+]
InChIInChI=1S/C13H18O2.K.H/c1-4-6-11-7-8-12(15-9-5-2)13(10-11)14-3;;/h4,7-8,10H,1,5-6,9H2,2-3H3;;/q;+1;-1
InChIKeyOCQOUFHLNUAWNE-UHFFFAOYSA-N
XLogP0.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-butoxy-2-methoxy-4-prop-2-enylbenzene
CID 3019586
2-methoxy-1-pentoxy-4-prop-2-enylbenzene
CID 3024287
2-methoxy-1-[6-(2-methoxy-4-prop-2-enylphenoxy)hexoxy]-4-prop-2-enylbenzene
CID 19906474
N-ethyl-2-(2-methoxy-4-prop-2-enylphenoxy)ethanamine
CID 6460350
2-methoxy-1-[3-(2-methoxy-4-methylphenoxy)propoxy]-4-prop-2-enylbenzene
CID 2283169
1,2-dimethoxy-4-prop-2-enylbenzene;ethane
CID 143927430
2-(2-methoxy-4-prop-2-enylphenoxy)ethyl-bis(prop-2-enyl)azanium
CID 7442982
1,3-dimethoxy-5-prop-2-enyl-2-propoxybenzene
CID 141497622
1-[4-(2-bromophenoxy)butoxy]-2-methoxy-4-prop-2-enylbenzene
CID 2899492
2-methoxy-1-prop-2-enoxy-4-prop-2-enylbenzene;2-methoxy-4-prop-2-enylphenol
CID 160676628
(2-methoxy-4-prop-2-enylphenoxy)phosphane
CID 155424724
1-[3-(2-chloro-4-methylphenoxy)propoxy]-2-methoxy-4-prop-2-enylbenzene
CID 2282941

Frequently Asked Questions

What is the IUPAC name of potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene?
The IUPAC name of potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene (CID 175484509) is potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene.
What is the SMILES notation for potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene?
The canonical SMILES for potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene is C=CCc1ccc(OCCC)c(OC)c1.[H-].[K+].
What is the InChIKey of potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene?
The InChIKey is OCQOUFHLNUAWNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2.K.H/c1-4-6-11-7-8-12(15-9-5-2)13(10-11)14-3;;/h4,7-8,10H,1,5-6,9H2,2-3H3;;/q;+1;-1.
What are the key properties of potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene?
potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene has a molecular weight of 246.39 g/mol, XLogP of 0.33, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;2-methoxy-4-prop-2-enyl-1-propoxybenzene is sourced from PubChem (CID 175484509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).